ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoate

Systemtic Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoate Openeye Name: ethyl 6-(p-tolylsulfonylamino)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoate Traditional Name: 6-(tosylamino)-2-[[4-(trifluoromethyl)phenyl]sulfonylamino]hexanoic acid ethyl ester Formula: C22H27F3N2O6S2 MolecularWeight: 536.58479

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C22H27F3N2O6S2/c1-3-33-21(28)20(27-35(31,32)19-13-9-17(10-14-19)22(23,24)25)6-4-5-15-26-34(29,30)18-11-7-16(2)8-12-18/h7-14,20,26-27H,3-6,15H2,1-2H3