null
  CDK     0224162202
null
 25 27  0  0  0  0  0  0  0  0999 V2000
    2.8787    1.4643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4090    0.8323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1234    0.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1234   -0.4052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4090   -0.8177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6945   -0.4052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6945    0.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9393    1.4643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6571    2.2395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1874    2.8715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7177    3.5035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4355    4.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9658    4.9107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7783    4.7675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    3.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5302    3.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8194    2.3412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5946    2.6234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2266    2.0931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0834    1.2806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3081    0.9984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6761    1.5287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5554    3.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6987    4.2143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7802    3.1196    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  2  1  0  0  0  0 
  2  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
 10 17  1  0  0  0  0 
 17 18  2  0  0  0  0 
 18 19  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 21 22  2  0  0  0  0 
 22 17  1  0  0  0  0 
 10 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 23 25  1  0  0  0  0 
M  CHG  1   2   1
M  END
> <ID>
CHEBI:94773

> <NAME>
4-(1-methyl-1-piperidin-1-iumyl)-2,2-diphenylbutanamide

> <STAR>
2

> <SYNONYM>
fenpiverinium bromide

> <FORMULA>
C22H29N2O

> <MASS>
337.479

> <MONOISOTOPIC_MASS>
337.22744

> <CHARGE>
1

> <SMILES>
C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N

> <INCHI>
InChI=1S/C22H28N2O/c1-24(16-9-4-10-17-24)18-15-22(21(23)25,19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3,(H-,23,25)/p+1

> <INCHIKEY>
QDIYJDPBMZUZEH-UHFFFAOYSA-O

> <CAS_REGISTRY_NUMBER>
258329-46-3

> <LINCS_ACCESSION>
LSM-5905

$$$$