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

Systemtic Name: 2-[4-(phenylmethyl)pyridin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-propyl-acetamide CAS Name: 2-[4-(phenylmethyl)-1-pyridin-1-iumyl]-N-propylacetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-propylacetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-propyl-acetamide Formula: C17H21N2O+ MolecularWeight: 269.36144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O/c1-2-10-18-17(20)14-19-11-8-16(9-12-19)13-15-6-4-3-5-7-15/h3-9,11-12H,2,10,13-14H2,1H3/p+1