diethyl 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-methyl-3-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C18H18F3NO4 MolecularWeight: 369.33503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2C(F)(F)F)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2C(F)(F)F)C(=O)OCC)C

InChI

InChI=1S/C18H18F3NO4/c1-4-25-16(23)13-10(3)22-15(17(24)26-5-2)14(13)11-8-6-7-9-12(11)18(19,20)21/h6-9,22H,4-5H2,1-3H3