2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]ethanoic acid Openeye Name: 2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetic acid CAS Name: 2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetic acid IUPAC Name: 2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetic acid Traditional Name: 2-[2-(4-aminophenyl)-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl]acetic acid Formula: C17H18N3O2+ MolecularWeight: 296.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)C3=CC=C(C=C3)N)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)C3=CC=C(C=C3)N)CC(=O)O

InChI

InChI=1S/C17H17N3O2/c1-10-7-14-15(8-11(10)2)20(9-16(21)22)17(19-14)12-3-5-13(18)6-4-12/h3-8H,9H2,1-2H3,(H3,18,19,21,22)/p+1