[(4-methylphenyl)sulfonylamino] 2-(4-ethoxy-4-oxidanylidene-butyl)-5-(trifluoromethyloxy)benzoate

Systemtic Name: [(4-methylphenyl)sulfonylamino] 2-(4-ethoxy-4-oxidanylidene-butyl)-5-(trifluoromethyloxy)benzoate Openeye Name: (p-tolylsulfonylamino) 2-(4-ethoxy-4-oxo-butyl)-5-(trifluoromethoxy)benzoate CAS Name: 2-(4-ethoxy-4-oxobutyl)-5-(trifluoromethoxy)benzoic acid [(4-methylphenyl)sulfonylamino] ester IUPAC Name: [(4-methylphenyl)sulfonylamino] 2-(4-ethoxy-4-oxobutyl)-5-(trifluoromethoxy)benzoate Traditional Name: 2-(4-ethoxy-4-keto-butyl)-5-(trifluoromethoxy)benzoic acid (tosylamino) ester Formula: C21H22F3NO7S MolecularWeight: 489.46209

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=C(C=C(C=C1)OC(F)(F)F)C(=O)ONS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CCCC1=C(C=C(C=C1)OC(F)(F)F)C(=O)ONS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H22F3NO7S/c1-3-30-19(26)6-4-5-15-9-10-16(31-21(22,23)24)13-18(15)20(27)32-25-33(28,29)17-11-7-14(2)8-12-17/h7-13,25H,3-6H2,1-2H3