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

Systemtic Name: 3-[[2-(aminomethyl)benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[2-(aminomethyl)benzimidazol-1-yl]methyl]benzoic acid CAS Name: 3-[[2-(aminomethyl)-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 3-[[2-(aminomethyl)benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[2-(aminomethyl)benzimidazol-1-yl]methyl]benzoic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2/c17-9-15-18-13-6-1-2-7-14(13)19(15)10-11-4-3-5-12(8-11)16(20)21/h1-8H,9-10,17H2,(H,20,21)