N-(3-methylbutylcarbamoyl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(isopentylcarbamoyl)acetamide CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-(isoamylcarbamoyl)acetamide Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)C[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)C[N+]1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H23N3O3/c1-15(2)8-11-21-20(26)22-18(24)14-23-12-9-17(10-13-23)19(25)16-6-4-3-5-7-16/h3-7,9-10,12-13,15H,8,11,14H2,1-2H3,(H-,21,22,24,26)/p+1