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

Systemtic Name: 2-[4-(phenylmethyl)pyridin-1-ium-1-yl]-N-(propylcarbamoyl)ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide CAS Name: N-[oxo(propylamino)methyl]-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-(propylcarbamoyl)acetamide Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2/c1-2-10-19-18(23)20-17(22)14-21-11-8-16(9-12-21)13-15-6-4-3-5-7-15/h3-9,11-12H,2,10,13-14H2,1H3,(H-,19,20,22,23)/p+1