methyl 6-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidin-4-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]amino]hexanoate CAS Name: 6-[[oxo-[1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonyl]amino]hexanoate Traditional Name: 6-[[1-[3-(trifluoromethyl)phenyl]sulfonylisonipecotoyl]amino]hexanoic acid methyl ester Formula: C20H27F3N2O5S MolecularWeight: 464.49899

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H27F3N2O5S/c1-30-18(26)8-3-2-4-11-24-19(27)15-9-12-25(13-10-15)31(28,29)17-7-5-6-16(14-17)20(21,22)23/h5-7,14-15H,2-4,8-13H2,1H3,(H,24,27)