3-piperidin-4-ylpropyl 2-[3,3-bis(fluoranyl)cyclopentyl]-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 3-piperidin-4-ylpropyl 2-[3,3-bis(fluoranyl)cyclopentyl]-2-oxidanyl-2-phenyl-ethanoate Openeye Name: 3-(4-piperidyl)propyl 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenyl-acetate CAS Name: 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetic acid 3-(4-piperidinyl)propyl ester IUPAC Name: 3-piperidin-4-ylpropyl 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetate Traditional Name: 2-(3,3-difluorocyclopentyl)-2-hydroxy-2-phenyl-acetic acid 3-(4-piperidyl)propyl ester Formula: C21H29F2NO3 MolecularWeight: 381.456666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1C(C2=CC=CC=C2)(C(=O)OCCCC3CCNCC3)O)(F)F

Isomeric SMILES

C1CC(CC1C(C2=CC=CC=C2)(C(=O)OCCCC3CCNCC3)O)(F)F

InChI

InChI=1S/C21H29F2NO3/c22-20(23)11-8-18(15-20)21(26,17-6-2-1-3-7-17)19(25)27-14-4-5-16-9-12-24-13-10-16/h1-3,6-7,16,18,24,26H,4-5,8-15H2