N-(2-methylpropylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-methylpropylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(isobutylcarbamoyl)acetamide CAS Name: N-[(2-methylpropylamino)-oxomethyl]-2-(4-pentan-3-yl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-(2-methylpropylcarbamoyl)-2-(4-pentan-3-ylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-[4-(1-ethylpropyl)pyridin-1-ium-1-yl]-N-(isobutylcarbamoyl)acetamide Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C17H27N3O2/c1-5-14(6-2)15-7-9-20(10-8-15)12-16(21)19-17(22)18-11-13(3)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H-,18,19,21,22)/p+1