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

Systemtic Name: piperidin-4-yl 2-[3,3-bis(fluoranyl)cyclopentyl]-2-(4-bromophenyl)-2-oxidanyl-ethanoate Openeye Name: 4-piperidyl 2-(4-bromophenyl)-2-(3,3-difluorocyclopentyl)-2-hydroxy-acetate CAS Name: 2-(4-bromophenyl)-2-(3,3-difluorocyclopentyl)-2-hydroxyacetic acid 4-piperidinyl ester IUPAC Name: piperidin-4-yl 2-(4-bromophenyl)-2-(3,3-difluorocyclopentyl)-2-hydroxyacetate Traditional Name: 2-(4-bromophenyl)-2-(3,3-difluorocyclopentyl)-2-hydroxy-acetic acid 4-piperidyl ester Formula: C18H22BrF2NO3 MolecularWeight: 418.272986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1C(C2=CC=C(C=C2)Br)(C(=O)OC3CCNCC3)O)(F)F

Isomeric SMILES

C1CC(CC1C(C2=CC=C(C=C2)Br)(C(=O)OC3CCNCC3)O)(F)F

InChI

InChI=1S/C18H22BrF2NO3/c19-14-3-1-12(2-4-14)18(24,13-5-8-17(20,21)11-13)16(23)25-15-6-9-22-10-7-15/h1-4,13,15,22,24H,5-11H2