dimethyl 5-[3-[(E)-2-cyano-3-[2-(trifluoromethyl)phenyl]prop-2-enoyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[(E)-2-cyano-3-[2-(trifluoromethyl)phenyl]prop-2-enoyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-[(E)-2-cyano-3-[2-(trifluoromethyl)phenyl]prop-2-enoyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[3-[(E)-2-cyano-1-oxo-3-[2-(trifluoromethyl)phenyl]prop-2-enyl]-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[(E)-2-cyano-3-[2-(trifluoromethyl)phenyl]prop-2-enoyl]-2,5-dimethylpyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-[(E)-2-cyano-3-[2-(trifluoromethyl)phenyl]acryloyl]-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C27H21F3N2O5 MolecularWeight: 510.46125

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)C(=CC3=CC=CC=C3C(F)(F)F)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C(=O)/C(=C/C3=CC=CC=C3C(F)(F)F)/C#N

InChI

InChI=1S/C27H21F3N2O5/c1-15-9-22(24(33)20(14-31)10-17-7-5-6-8-23(17)27(28,29)30)16(2)32(15)21-12-18(25(34)36-3)11-19(13-21)26(35)37-4/h5-13H,1-4H3/b20-10+