Chemical Components in the PDB

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OUL : Summary

Code

OUL

One-letter code

X

Molecule name

4-(4-aminocarbonylphenoxy)benzamide

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 4-(4-aminocarbonylphenoxy)benzamide

Formula

C14 H12 N2 O3

Formal charge

0

Molecular weight

256.257 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 NC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1
SMILES OpenEye OEToolkits 2.0.6 c1cc(ccc1C(=O)N)Oc2ccc(cc2)C(=O)N
Canonical SMILES CACTVS 3.385 NC(=O)c1ccc(Oc2ccc(cc2)C(N)=O)cc1
Canonical SMILES OpenEye OEToolkits 2.0.6 c1cc(ccc1C(=O)N)Oc2ccc(cc2)C(=O)N

IUPAC InChI

InChI=1S/C14H12N2O3/c15-13(17)9-1-5-11(6-2-9)19-12-7-3-10(4-8-12)14(16)18/h1-8H,(H2,15,17)(H2,16,18)

IUPAC InChI key

XZRCQWLPMXFGHE-UHFFFAOYSA-N
OUL

wwPDB Information

Atom count

31 (19 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2017-09-25

Last modified at

2020-06-17

Status

Released

Obsoleted

Not Assigned