3-[[2-(aminomethyl)-5,6-dimethyl-benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[2-(aminomethyl)-5,6-dimethyl-benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[2-(aminomethyl)-5,6-dimethyl-benzimidazol-1-yl]methyl]benzoic acid CAS Name: 3-[[2-(aminomethyl)-5,6-dimethyl-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 3-[[2-(aminomethyl)-5,6-dimethylbenzimidazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[2-(aminomethyl)-5,6-dimethyl-benzimidazol-1-yl]methyl]benzoic acid Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CN)CC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CN)CC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C18H19N3O2/c1-11-6-15-16(7-12(11)2)21(17(9-19)20-15)10-13-4-3-5-14(8-13)18(22)23/h3-8H,9-10,19H2,1-2H3,(H,22,23)