methyl (5E)-3,3-dicyano-5-[methoxy(oxidanyl)methylidene]-2-(4-methylphenyl)-6-oxidanylidene-4-phenyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (5E)-3,3-dicyano-5-[methoxy(oxidanyl)methylidene]-2-(4-methylphenyl)-6-oxidanylidene-4-phenyl-cyclohexane-1-carboxylate Openeye Name: methyl (5E)-3,3-dicyano-5-[hydroxy(methoxy)methylene]-6-oxo-4-phenyl-2-(p-tolyl)cyclohexanecarboxylate CAS Name: (5E)-3,3-dicyano-5-[hydroxy(methoxy)methylidene]-2-(4-methylphenyl)-6-oxo-4-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (5E)-3,3-dicyano-5-[hydroxy(methoxy)methylidene]-2-(4-methylphenyl)-6-oxo-4-phenylcyclohexane-1-carboxylate Traditional Name: (5E)-3,3-dicyano-5-[hydroxy(methoxy)methylene]-6-keto-4-phenyl-2-(p-tolyl)cyclohexanecarboxylic acid methyl ester Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)C(=C(O)OC)C(C2(C#N)C#N)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)/C(=C(\O)/OC)/C(C2(C#N)C#N)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H22N2O5/c1-15-9-11-17(12-10-15)21-19(24(30)32-3)22(28)18(23(29)31-2)20(25(21,13-26)14-27)16-7-5-4-6-8-16/h4-12,19-21,29H,1-3H3/b23-18+