N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(phenylcarbonyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-(4-benzoyl-1-pyridin-1-iumyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(4-benzoylpyridin-1-ium-1-yl)-N-homoveratryl-acetamide Formula: C24H25N2O4+ MolecularWeight: 405.4663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H24N2O4/c1-29-21-9-8-18(16-22(21)30-2)10-13-25-23(27)17-26-14-11-20(12-15-26)24(28)19-6-4-3-5-7-19/h3-9,11-12,14-16H,10,13,17H2,1-2H3/p+1