38282
  CDK     0409211651

 14 15  0  0  0  0  0  0  0  0999 V2000
    4.2241    2.5097    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1615    0.3663    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5741   -1.9982    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5741   -0.3482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2885   -0.7607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8596   -0.7607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2885   -1.5857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8596   -1.5857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9866    0.3663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5741    1.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8116    0.3663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9866    1.7952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2241    1.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8116    1.7952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 14  1  0  0  0  0 
  2  4  1  0  0  0  0 
  3  7  1  0  0  0  0 
  3  8  1  0  0  0  0 
  4  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  4  9  1  0  0  0  0 
  5  7  1  0  0  0  0 
  6  8  1  0  0  0  0 
  9 10  2  0  0  0  0 
  9 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
 11 13  2  0  0  0  0 
 12 14  2  0  0  0  0 
 13 14  1  0  0  0  0 
M  END
> <ID>
CHEBI:169225

> <NAME>
4-(4-chlorophenyl)-4-hydroxypiperidine

> <STAR>
2

> <IUPAC_NAME>
4-(4-chlorophenyl)piperidin-4-ol

> <FORMULA>
C11H14ClNO

> <MASS>
211.690

> <MONOISOTOPIC_MASS>
211.07639

> <CHARGE>
0

> <SMILES>
ClC1=CC=C(C2(O)CCNCC2)C=C1

> <INCHI>
InChI=1S/C11H14ClNO/c12-10-3-1-9(2-4-10)11(14)5-7-13-8-6-11/h1-4,13-14H,5-8H2

> <INCHIKEY>
LZAYOZUFUAMFLD-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
39512-49-7

> <CHEMIDPLUS>
39512-49-7

$$$$