[4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]methyl cyclohexanecarboxylate

Systemtic Name: [4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]methyl cyclohexanecarboxylate Openeye Name: [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]methyl cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)-1-pyrrolyl]methyl ester IUPAC Name: [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]methyl cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]methyl ester Formula: C20H17BrClF3N2O2 MolecularWeight: 489.71339

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OCN2C(=C(C(=C2C(F)(F)F)Br)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)OCN2C(=C(C(=C2C(F)(F)F)Br)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H17BrClF3N2O2/c21-16-15(10-26)17(12-6-8-14(22)9-7-12)27(18(16)20(23,24)25)11-29-19(28)13-4-2-1-3-5-13/h6-9,13H,1-5,11H2