[1-[2-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidin-4-yl] carbamate

Systemtic Name: [1-[2-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-piperidin-4-yl] carbamate Openeye Name: [1-[2-[1-[3,5-bis(trifluoromethyl)benzoyl]-3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-4-piperidyl] carbamate CAS Name: carbamic acid [1-[2-[1-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-3-(3,4-dichlorophenyl)-3-pyrrolidinyl]ethyl]-4-phenyl-4-piperidinyl] ester IUPAC Name: [1-[2-[1-[3,5-bis(trifluoromethyl)benzoyl]-3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidin-4-yl] carbamate Traditional Name: carbamic acid [1-[2-[1-[3,5-bis(trifluoromethyl)benzoyl]-3-(3,4-dichlorophenyl)pyrrolidin-3-yl]ethyl]-4-phenyl-4-piperidyl] ester Formula: C33H31Cl2F6N3O3 MolecularWeight: 702.513959

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)OC(=O)N)CCC3(CCN(C3)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)OC(=O)N)CCC3(CCN(C3)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C33H31Cl2F6N3O3/c34-26-7-6-23(19-27(26)35)30(8-12-43-13-10-31(11-14-43,47-29(42)46)22-4-2-1-3-5-22)9-15-44(20-30)28(45)21-16-24(32(36,37)38)18-25(17-21)33(39,40)41/h1-7,16-19H,8-15,20H2,(H2,42,46)