tert-butyl 4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethylcarbamoyl]-4-phenyl-cyclohexyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethylcarbamoyl]-4-phenyl-cyclohexyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethylcarbamoyl]-4-phenyl-cyclohexyl]piperazine-1-carboxylate CAS Name: 4-[4-[[1-[3,5-bis(trifluoromethyl)phenyl]ethylamino]-oxomethyl]-4-phenylcyclohexyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethylcarbamoyl]-4-phenylcyclohexyl]piperazine-1-carboxylate Traditional Name: 4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]ethylcarbamoyl]-4-phenyl-cyclohexyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C32H39F6N3O3 MolecularWeight: 627.660779

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)NC(=O)C2(CCC(CC2)N3CCN(CC3)C(=O)OC(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)NC(=O)C2(CCC(CC2)N3CCN(CC3)C(=O)OC(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C32H39F6N3O3/c1-21(22-18-24(31(33,34)35)20-25(19-22)32(36,37)38)39-27(42)30(23-8-6-5-7-9-23)12-10-26(11-13-30)40-14-16-41(17-15-40)28(43)44-29(2,3)4/h5-9,18-21,26H,10-17H2,1-4H3,(H,39,42)