[2-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] cyclohexanecarboxylate

Systemtic Name: [2-[[4-chloranyl-2-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] cyclohexanecarboxylate Openeye Name: [2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxo-1-phenyl-ethyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [2-[4-chloro-2-(trifluoromethyl)anilino]-2-keto-1-phenyl-ethyl] ester Formula: C22H21ClF3NO3 MolecularWeight: 439.85525

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C22H21ClF3NO3/c23-16-11-12-18(17(13-16)22(24,25)26)27-20(28)19(14-7-3-1-4-8-14)30-21(29)15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,19H,2,5-6,9-10H2,(H,27,28)