ethyl 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carboxylate Openeye Name: ethyl 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carboxylate CAS Name: 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carboxylate Traditional Name: 5-methyl-2-phenyl-1-[3-(trifluoromethyl)phenyl]pyrrole-3-carboxylic acid ethyl ester Formula: C21H18F3NO2 MolecularWeight: 373.36833

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)C2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H18F3NO2/c1-3-27-20(26)18-12-14(2)25(19(18)15-8-5-4-6-9-15)17-11-7-10-16(13-17)21(22,23)24/h4-13H,3H2,1-2H3