methyl 4-[[5-cyano-3-[(4-methoxycarbonylphenyl)methylidene]-2-oxidanylidene-5-phenyl-cyclohexylidene]methyl]benzoate

Systemtic Name: methyl 4-[[5-cyano-3-[(4-methoxycarbonylphenyl)methylidene]-2-oxidanylidene-5-phenyl-cyclohexylidene]methyl]benzoate Openeye Name: methyl 4-[[5-cyano-3-[(4-methoxycarbonylphenyl)methylene]-2-oxo-5-phenyl-cyclohexylidene]methyl]benzoate CAS Name: 4-[[5-cyano-3-[(4-methoxycarbonylphenyl)methylidene]-2-oxo-5-phenylcyclohexylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-cyano-3-[(4-methoxycarbonylphenyl)methylidene]-2-oxo-5-phenylcyclohexylidene]methyl]benzoate Traditional Name: 4-[[3-(4-carbomethoxybenzylidene)-5-cyano-2-keto-5-phenyl-cyclohexylidene]methyl]benzoic acid methyl ester Formula: C31H25NO5 MolecularWeight: 491.5339

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2CC(CC(=CC3=CC=C(C=C3)C(=O)OC)C2=O)(C#N)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=C2CC(CC(=CC3=CC=C(C=C3)C(=O)OC)C2=O)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C31H25NO5/c1-36-29(34)23-12-8-21(9-13-23)16-25-18-31(20-32,27-6-4-3-5-7-27)19-26(28(25)33)17-22-10-14-24(15-11-22)30(35)37-2/h3-17H,18-19H2,1-2H3