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

Systemtic Name: N-(3-methylbutylcarbamoyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(isopentylcarbamoyl)acetamide CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(isoamylcarbamoyl)acetamide Formula: C13H20N3O3+ MolecularWeight: 266.3162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3/c1-10(2)5-6-14-13(19)15-12(18)9-16-7-3-4-11(17)8-16/h3-4,7-8,10H,5-6,9H2,1-2H3,(H2-,14,15,17,18,19)/p+1