[3,3-bis(fluoranyl)cyclopentyl] 2-(4-bromophenyl)-2-oxidanyl-4-piperidin-4-yl-butanoate

Systemtic Name: [3,3-bis(fluoranyl)cyclopentyl] 2-(4-bromophenyl)-2-oxidanyl-4-piperidin-4-yl-butanoate Openeye Name: (3,3-difluorocyclopentyl) 2-(4-bromophenyl)-2-hydroxy-4-(4-piperidyl)butanoate CAS Name: 2-(4-bromophenyl)-2-hydroxy-4-(4-piperidinyl)butanoic acid (3,3-difluorocyclopentyl) ester IUPAC Name: (3,3-difluorocyclopentyl) 2-(4-bromophenyl)-2-hydroxy-4-piperidin-4-ylbutanoate Traditional Name: 2-(4-bromophenyl)-2-hydroxy-4-(4-piperidyl)butyric acid (3,3-difluorocyclopentyl) ester Formula: C20H26BrF2NO3 MolecularWeight: 446.326146

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1OC(=O)C(CCC2CCNCC2)(C3=CC=C(C=C3)Br)O)(F)F

Isomeric SMILES

C1CC(CC1OC(=O)C(CCC2CCNCC2)(C3=CC=C(C=C3)Br)O)(F)F

InChI

InChI=1S/C20H26BrF2NO3/c21-16-3-1-15(2-4-16)20(26,10-5-14-7-11-24-12-8-14)18(25)27-17-6-9-19(22,23)13-17/h1-4,14,17,24,26H,5-13H2