[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 3-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C16H19F3N2O5S MolecularWeight: 408.39267

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCC(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCC(F)(F)F

InChI

InChI=1S/C16H19F3N2O5S/c17-16(18,19)11-20-14(22)10-26-15(23)12-5-4-6-13(9-12)27(24,25)21-7-2-1-3-8-21/h4-6,9H,1-3,7-8,10-11H2,(H,20,22)