2-(3-ethenylbenzimidazol-1-ium-1-yl)-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-(3-ethenylbenzimidazol-1-ium-1-yl)-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: N-(isopentylcarbamoyl)-2-(3-vinylbenzimidazol-1-ium-1-yl)acetamide CAS Name: 2-(3-ethenyl-1-benzimidazol-1-iumyl)-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(3-ethenylbenzimidazol-1-ium-1-yl)-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: N-(isoamylcarbamoyl)-2-(3-vinylbenzimidazol-1-ium-1-yl)acetamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)C[N+]1=CN(C2=CC=CC=C21)C=C

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)C[N+]1=CN(C2=CC=CC=C21)C=C

InChI

InChI=1S/C17H22N4O2/c1-4-20-12-21(15-8-6-5-7-14(15)20)11-16(22)19-17(23)18-10-9-13(2)3/h4-8,12-13H,1,9-11H2,2-3H3,(H-,18,19,22,23)/p+1