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

Systemtic Name: dimethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyano-prop-2-enoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-1-oxoprop-2-enyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[(E)-3-(4-chlorophenyl)-2-cyanoprop-2-enoyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[(E)-3-(4-chlorophenyl)-2-cyano-acryloyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H15ClN2O5 MolecularWeight: 398.7965

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C(=CC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)/C(=C/C2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C20H15ClN2O5/c1-27-19(25)13-5-8-16(20(26)28-2)17(10-13)23-18(24)14(11-22)9-12-3-6-15(21)7-4-12/h3-10H,1-2H3,(H,23,24)/b14-9+