ethyl 5-[[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[[4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]furan-2-carboxylate Openeye Name: ethyl 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidyl]methyl]furan-2-carboxylate CAS Name: 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidinyl]methyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidino]methyl]furan-2-carboxylic acid ethyl ester Formula: C20H22F3NO4 MolecularWeight: 397.38819

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)CN2CCC(CC2)(C3=CC(=CC=C3)C(F)(F)F)O

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)CN2CCC(CC2)(C3=CC(=CC=C3)C(F)(F)F)O

InChI

InChI=1S/C20H22F3NO4/c1-2-27-18(25)17-7-6-16(28-17)13-24-10-8-19(26,9-11-24)14-4-3-5-15(12-14)20(21,22)23/h3-7,12,26H,2,8-11,13H2,1H3