1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methyl-pyridin-1-ium CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methylpyridin-1-ium IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-bis(4-ethoxyphenyl)-6-methylpyridin-1-ium Traditional Name: 1-homoveratryl-2-methyl-4,6-bis(p-phenetyl)pyridin-1-ium Formula: C32H36NO4+ MolecularWeight: 498.63254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C)CCC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C)CCC3=CC(=C(C=C3)OC)OC)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C32H36NO4/c1-6-36-28-13-9-25(10-14-28)27-20-23(3)33(19-18-24-8-17-31(34-4)32(21-24)35-5)30(22-27)26-11-15-29(16-12-26)37-7-2/h8-17,20-22H,6-7,18-19H2,1-5H3/q+1