1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]pyrrolidin-1-yl]-2-(2-chloranyl-6-fluoranyl-phenyl)ethanone

Systemtic Name: 1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]pyrrolidin-1-yl]-2-(2-chloranyl-6-fluoranyl-phenyl)ethanone Openeye Name: 1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-[4-(1-piperidyl)-1-piperidyl]ethyl]pyrrolidin-1-yl]-2-(2-chloro-6-fluoro-phenyl)ethanone CAS Name: 1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-[4-(1-piperidinyl)-1-piperidinyl]ethyl]-1-pyrrolidinyl]-2-(2-chloro-6-fluorophenyl)ethanone IUPAC Name: 1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]pyrrolidin-1-yl]-2-(2-chloro-6-fluorophenyl)ethanone Traditional Name: 1-[3-[3,4-bis(trichloromethyl)phenyl]-3-[2-(4-piperidinopiperidino)ethyl]pyrrolidino]-2-(2-chloro-6-fluoro-phenyl)ethanone Formula: C32H37Cl7FN3O MolecularWeight: 746.825083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)CCC3(CCN(C3)C(=O)CC4=C(C=CC=C4Cl)F)C5=CC(=C(C=C5)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)CCC3(CCN(C3)C(=O)CC4=C(C=CC=C4Cl)F)C5=CC(=C(C=C5)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

InChI

InChI=1S/C32H37Cl7FN3O/c33-27-5-4-6-28(40)24(27)20-29(44)43-18-12-30(21-43,22-7-8-25(31(34,35)36)26(19-22)32(37,38)39)11-17-41-15-9-23(10-16-41)42-13-2-1-3-14-42/h4-8,19,23H,1-3,9-18,20-21H2