3-[6-azanyl-1-(phenylmethyl)benzimidazol-2-yl]propanoic acid

Systemtic Name: 3-[6-azanyl-1-(phenylmethyl)benzimidazol-2-yl]propanoic acid Openeye Name: 3-(6-amino-1-benzyl-benzimidazol-2-yl)propanoic acid CAS Name: 3-[6-amino-1-(phenylmethyl)-2-benzimidazolyl]propanoic acid IUPAC Name: 3-(6-amino-1-benzylbenzimidazol-2-yl)propanoic acid Traditional Name: 3-(6-amino-1-benzyl-benzimidazol-2-yl)propionic acid Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)N)N=C2CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)N)N=C2CCC(=O)O

InChI

InChI=1S/C17H17N3O2/c18-13-6-7-14-15(10-13)20(11-12-4-2-1-3-5-12)16(19-14)8-9-17(21)22/h1-7,10H,8-9,11,18H2,(H,21,22)