methyl 2-[[2-cyano-3-[3-methoxy-4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 2-[[2-cyano-3-[3-methoxy-4-(phenylcarbonyloxy)phenyl]prop-2-enoyl]amino]benzoate Openeye Name: methyl 2-[[3-(4-benzoyloxy-3-methoxy-phenyl)-2-cyano-prop-2-enoyl]amino]benzoate CAS Name: 2-[[3-(4-benzoyloxy-3-methoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[3-(4-benzoyloxy-3-methoxyphenyl)-2-cyanoprop-2-enoyl]amino]benzoate Traditional Name: 2-[[3-(4-benzoyloxy-3-methoxy-phenyl)-2-cyano-acryloyl]amino]benzoic acid methyl ester Formula: C26H20N2O6 MolecularWeight: 456.4468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)OC)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)OC)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H20N2O6/c1-32-23-15-17(12-13-22(23)34-25(30)18-8-4-3-5-9-18)14-19(16-27)24(29)28-21-11-7-6-10-20(21)26(31)33-2/h3-15H,1-2H3,(H,28,29)