2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl 4-(4-chlorophenyl)-4-oxidanyl-piperidine-1-carboxylate

Systemtic Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl 4-(4-chlorophenyl)-4-oxidanyl-piperidine-1-carboxylate Openeye Name: 2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl 4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-(4-chlorophenyl)-4-hydroxy-1-piperidinecarboxylic acid 2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl ester IUPAC Name: 2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl 4-(4-chlorophenyl)-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-(4-chlorophenyl)-4-hydroxy-piperidine-1-carboxylic acid 2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethyl ester Formula: C20H20ClF3N2O3S MolecularWeight: 460.89761

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)C(=O)OCCSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)C(=O)OCCSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N2O3S/c21-16-4-1-14(2-5-16)19(28)7-9-26(10-8-19)18(27)29-11-12-30-17-6-3-15(13-25-17)20(22,23)24/h1-6,13,28H,7-12H2