ethyl 2-[[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-2-cyano-3-(3,4,5-trimethoxyphenyl)acryloyl]amino]benzoic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C(=C2)OC)OC)OC)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)/C(=C/C2=CC(=C(C(=C2)OC)OC)OC)/C#N

InChI

InChI=1S/C22H22N2O6/c1-5-30-22(26)16-8-6-7-9-17(16)24-21(25)15(13-23)10-14-11-18(27-2)20(29-4)19(12-14)28-3/h6-12H,5H2,1-4H3,(H,24,25)/b15-10+