3-[[2-(3-aminophenyl)benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[2-(3-aminophenyl)benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[2-(3-aminophenyl)benzimidazol-1-yl]methyl]benzoic acid CAS Name: 3-[[2-(3-aminophenyl)-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 3-[[2-(3-aminophenyl)benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[2-(3-aminophenyl)benzimidazol-1-yl]methyl]benzoic acid Formula: C21H17N3O2 MolecularWeight: 343.37858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC(=C3)C(=O)O)C4=CC(=CC=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC3=CC=CC(=C3)C(=O)O)C4=CC(=CC=C4)N

InChI

InChI=1S/C21H17N3O2/c22-17-8-4-6-15(12-17)20-23-18-9-1-2-10-19(18)24(20)13-14-5-3-7-16(11-14)21(25)26/h1-12H,13,22H2,(H,25,26)