methyl 4-bromanyl-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-bromanyl-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylate CAS Name: 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylate Traditional Name: 4-bromo-2-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C13H8BrClF3NO2 MolecularWeight: 382.56033

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=C1Br)C(F)(F)F)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=C(NC(=C1Br)C(F)(F)F)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H8BrClF3NO2/c1-21-12(20)8-9(14)11(13(16,17)18)19-10(8)6-2-4-7(15)5-3-6/h2-5,19H,1H3