[2-(trifluoromethyl)phenyl]methyl 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 4-chloro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)benzoic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 4-chloro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-piperidinosulfonyl-benzoic acid [2-(trifluoromethyl)benzyl] ester Formula: C20H19ClF3NO4S MolecularWeight: 461.88237

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC=C3C(F)(F)F)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC=C3C(F)(F)F)Cl

InChI

InChI=1S/C20H19ClF3NO4S/c21-17-9-8-14(12-18(17)30(27,28)25-10-4-1-5-11-25)19(26)29-13-15-6-2-3-7-16(15)20(22,23)24/h2-3,6-9,12H,1,4-5,10-11,13H2