ethyl 2-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-methyl-4-[3-(trifluoromethyl)benzyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H16F3NO2 MolecularWeight: 311.29895

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC=C1CC2=CC(=CC=C2)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC=C1CC2=CC(=CC=C2)C(F)(F)F)C

InChI

InChI=1S/C16H16F3NO2/c1-3-22-15(21)14-10(2)20-9-12(14)7-11-5-4-6-13(8-11)16(17,18)19/h4-6,8-9,20H,3,7H2,1-2H3