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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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