methyl 2-[[(Z)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[[(Z)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[(Z)-2-cyano-3-(4-methoxyanilino)-3-oxo-prop-1-enyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[(Z)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[(Z)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[(Z)-2-cyano-3-keto-3-(p-anisidino)prop-1-enyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CNC2=CC(=C(C=C2C(=O)OC)OC)OC)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C\NC2=CC(=C(C=C2C(=O)OC)OC)OC)/C#N

InChI

InChI=1S/C21H21N3O6/c1-27-15-7-5-14(6-8-15)24-20(25)13(11-22)12-23-17-10-19(29-3)18(28-2)9-16(17)21(26)30-4/h5-10,12,23H,1-4H3,(H,24,25)/b13-12-