4-oxidanylidene-4-[[1-(phenylmethyl)benzimidazol-5-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[1-(phenylmethyl)benzimidazol-5-yl]amino]butanoic acid Openeye Name: 4-[(1-benzylbenzimidazol-5-yl)amino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[[1-(phenylmethyl)-5-benzimidazolyl]amino]butanoic acid IUPAC Name: 4-[(1-benzylbenzimidazol-5-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(1-benzylbenzimidazol-5-yl)amino]-4-keto-butyric acid Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2C=CC(=C3)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2C=CC(=C3)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H17N3O3/c22-17(8-9-18(23)24)20-14-6-7-16-15(10-14)19-12-21(16)11-13-4-2-1-3-5-13/h1-7,10,12H,8-9,11H2,(H,20,22)(H,23,24)