ethyl 2-[[(E)-2-cyano-3-[4-(4-methylphenyl)carbonyloxyphenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-[4-(4-methylphenyl)carbonyloxyphenyl]prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[(E)-2-cyano-3-[4-(4-methylbenzoyl)oxyphenyl]prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-2-cyano-3-[4-[(4-methylphenyl)-oxomethoxy]phenyl]-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-[4-(4-methylbenzoyl)oxyphenyl]prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-2-cyano-3-(4-p-toluoyloxyphenyl)acryloyl]amino]benzoic acid ethyl ester Formula: C27H22N2O5 MolecularWeight: 454.47398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)/C(=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C)/C#N

InChI

InChI=1S/C27H22N2O5/c1-3-33-27(32)23-6-4-5-7-24(23)29-25(30)21(17-28)16-19-10-14-22(15-11-19)34-26(31)20-12-8-18(2)9-13-20/h4-16H,3H2,1-2H3,(H,29,30)/b21-16+