[2-(trifluoromethyl)phenyl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid [2-(trifluoromethyl)benzyl] ester Formula: C19H19F3N2O4S MolecularWeight: 428.42537

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H19F3N2O4S/c20-19(21,22)17-6-2-1-4-15(17)13-28-18(25)14-7-10-24(11-8-14)29(26,27)16-5-3-9-23-12-16/h1-6,9,12,14H,7-8,10-11,13H2