methyl 2-methyl-6-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-methyl-6-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: methyl 2-methyl-6-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]amino]benzoate CAS Name: 2-methyl-6-[[oxo-[1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-6-[[1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]amino]benzoate Traditional Name: 2-methyl-6-[[1-[2-(trifluoromethyl)phenyl]sulfonylisonipecotoyl]amino]benzoic acid methyl ester Formula: C22H23F3N2O5S MolecularWeight: 484.48863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C(=O)OC

InChI

InChI=1S/C22H23F3N2O5S/c1-14-6-5-8-17(19(14)21(29)32-2)26-20(28)15-10-12-27(13-11-15)33(30,31)18-9-4-3-7-16(18)22(23,24)25/h3-9,15H,10-13H2,1-2H3,(H,26,28)