2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanamide

Systemtic Name: 2-[3-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanamide Openeye Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)acetamide CAS Name: 2-[3-(phenylmethyl)-1-benzimidazol-3-iumyl]acetamide IUPAC Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)acetamide Traditional Name: 2-(3-benzylbenzimidazol-3-ium-1-yl)acetamide Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CN(C3=CC=CC=C32)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CN(C3=CC=CC=C32)CC(=O)N

InChI

InChI=1S/C16H15N3O/c17-16(20)11-19-12-18(10-13-6-2-1-3-7-13)14-8-4-5-9-15(14)19/h1-9,12H,10-11H2,(H-,17,20)/p+1