1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(2-hydroxy-5-methoxy-benzoyl)-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(2-hydroxy-5-methoxybenzoyl)-2-oxopyridine-3-carbonitrile Traditional Name: 1-homoveratryl-5-(2-hydroxy-5-methoxy-benzoyl)-2-keto-nicotinonitrile Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)C2=CN(C(=O)C(=C2)C#N)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H22N2O6/c1-30-18-5-6-20(27)19(12-18)23(28)17-11-16(13-25)24(29)26(14-17)9-8-15-4-7-21(31-2)22(10-15)32-3/h4-7,10-12,14,27H,8-9H2,1-3H3