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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-(4-benzylpyridin-1-ium-1-yl)-N-homoveratryl-acetamide Formula: C24H27N2O3+ MolecularWeight: 391.48278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C24H26N2O3/c1-28-22-9-8-20(17-23(22)29-2)10-13-25-24(27)18-26-14-11-21(12-15-26)16-19-6-4-3-5-7-19/h3-9,11-12,14-15,17H,10,13,16,18H2,1-2H3/p+1