ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-5-(3-methylphenyl)-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-5-(3-methylphenyl)-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: ethyl 2-(2-ethoxy-2-oxo-ethyl)-1-methyl-5-(m-tolyl)-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: 2-(2-ethoxy-2-oxoethyl)-1-methyl-5-(3-methylphenyl)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-ethoxy-2-oxoethyl)-1-methyl-5-(3-methylphenyl)-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: 2-(2-ethoxy-2-keto-ethyl)-1-methyl-5-(m-tolyl)-4-(trifluoromethyl)pyrrole-3-carboxylic acid ethyl ester Formula: C20H22F3NO4 MolecularWeight: 397.38819

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=C(N1C)C2=CC(=CC=C2)C)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(=C(N1C)C2=CC(=CC=C2)C)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C20H22F3NO4/c1-5-27-15(25)11-14-16(19(26)28-6-2)17(20(21,22)23)18(24(14)4)13-9-7-8-12(3)10-13/h7-10H,5-6,11H2,1-4H3