3-(1H-benzimidazol-3-ium-2-yl)propanoate

Systemtic Name: 3-(1H-benzimidazol-3-ium-2-yl)propanoate Openeye Name: 3-(1H-benzimidazol-3-ium-2-yl)propanoate CAS Name: 3-(1H-benzimidazol-3-ium-2-yl)propanoate IUPAC Name: 3-(1H-benzimidazol-3-ium-2-yl)propanoate Traditional Name: 3-(1H-benzimidazol-3-ium-2-yl)propionate Formula: C10H10N2O2 MolecularWeight: 190.1986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)CCC(=O)[O-]

InChI

InChI=1S/C10H10N2O2/c13-10(14)6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12)(H,13,14)