2-(4-methylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)ethanamide

Systemtic Name: 2-(4-methylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)ethanamide Openeye Name: 2-(4-methylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide CAS Name: 2-(4-methyl-1-pyridin-1-iumyl)-N-[oxo(propylamino)methyl]acetamide IUPAC Name: 2-(4-methylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide Formula: C12H18N3O2+ MolecularWeight: 236.29022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O2/c1-3-6-13-12(17)14-11(16)9-15-7-4-10(2)5-8-15/h4-5,7-8H,3,6,9H2,1-2H3,(H-,13,14,16,17)/p+1