[2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl] 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: [2-oxidanylidene-4-(trifluoromethyl)chromen-7-yl] 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Openeye Name: [2-oxo-4-(trifluoromethyl)chromen-7-yl] 4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxylate CAS Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxylic acid [2-oxo-4-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-4-(trifluoromethyl)chromen-7-yl] 4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxylate Traditional Name: 4-[(tosylamino)methyl]cyclohexanecarboxylic acid [2-keto-4-(trifluoromethyl)chromen-7-yl] ester Formula: C25H24F3NO6S MolecularWeight: 523.52137

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)OC3=CC4=C(C=C3)C(=CC(=O)O4)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)OC3=CC4=C(C=C3)C(=CC(=O)O4)C(F)(F)F

InChI

InChI=1S/C25H24F3NO6S/c1-15-2-9-19(10-3-15)36(32,33)29-14-16-4-6-17(7-5-16)24(31)34-18-8-11-20-21(25(26,27)28)13-23(30)35-22(20)12-18/h2-3,8-13,16-17,29H,4-7,14H2,1H3