dimethyl 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(E)-2-cyano-3-(3,4-dimethoxyphenyl)acryloyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C22H20N2O7/c1-28-18-6-5-13(8-19(18)29-2)7-16(12-23)20(25)24-17-10-14(21(26)30-3)9-15(11-17)22(27)31-4/h5-11H,1-4H3,(H,24,25)/b16-7+