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

Systemtic Name: ethyl 5-(4-chlorophenyl)carbonyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxo-ethyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-2-(2-ethoxy-2-oxoethyl)-1-methyl-4-(trifluoromethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-oxoethyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: 5-(4-chlorobenzoyl)-2-(2-ethoxy-2-keto-ethyl)-1-methyl-4-(trifluoromethyl)pyrrole-3-carboxylic acid ethyl ester Formula: C20H19ClF3NO5 MolecularWeight: 445.81677

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClF3NO5/c1-4-29-14(26)10-13-15(19(28)30-5-2)16(20(22,23)24)17(25(13)3)18(27)11-6-8-12(21)9-7-11/h6-9H,4-5,10H2,1-3H3