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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C(C(C1)Br)C#N)C2=CC=C(C=C2)Cl)N3C=CC=C3C(F)(F)F

Isomeric SMILES

COC(=O)C1(CC(C(C(C1)Br)C#N)C2=CC=C(C=C2)Cl)N3C=CC=C3C(F)(F)F

InChI

InChI=1S/C20H17BrClF3N2O2/c1-29-18(28)19(27-8-2-3-17(27)20(23,24)25)9-14(15(11-26)16(21)10-19)12-4-6-13(22)7-5-12/h2-8,14-16H,9-10H2,1H3