[2-(trifluoromethyl)phenyl]methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: [2-(trifluoromethyl)phenyl]methyl 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: [2-(trifluoromethyl)phenyl]methyl 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid [2-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [2-(trifluoromethyl)phenyl]methyl 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid [2-(trifluoromethyl)benzyl] ester Formula: C21H22F3NO4S MolecularWeight: 441.46389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22F3NO4S/c22-21(23,24)19-7-3-2-6-17(19)15-29-20(26)14-16-8-10-18(11-9-16)30(27,28)25-12-4-1-5-13-25/h2-3,6-11H,1,4-5,12-15H2