N-(2-methylpropylcarbamoyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methylpropylcarbamoyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(isobutylcarbamoyl)acetamide CAS Name: N-[(2-methylpropylamino)-oxomethyl]-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(isobutylcarbamoyl)acetamide Formula: C19H24N3O2+ MolecularWeight: 326.41276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C[N+]1=CC=C(C=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C[N+]1=CC=C(C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O2/c1-15(2)13-20-19(24)21-18(23)14-22-10-8-17(9-11-22)12-16-6-4-3-5-7-16/h3-11,15H,12-14H2,1-2H3,(H-,20,21,23,24)/p+1