[2-oxidanylidene-3-[4-(trifluoromethyloxy)phenyl]chromen-4-yl] 4-methylbenzenesulfonate

Systemtic Name: [2-oxidanylidene-3-[4-(trifluoromethyloxy)phenyl]chromen-4-yl] 4-methylbenzenesulfonate Openeye Name: [2-oxo-3-[4-(trifluoromethoxy)phenyl]chromen-4-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-oxo-3-[4-(trifluoromethoxy)phenyl]-1-benzopyran-4-yl] ester IUPAC Name: [2-oxo-3-[4-(trifluoromethoxy)phenyl]chromen-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-keto-3-[4-(trifluoromethoxy)phenyl]chromen-4-yl] ester Formula: C23H15F3O6S MolecularWeight: 476.42181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=CC=CC=C32)C4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=CC=CC=C32)C4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C23H15F3O6S/c1-14-6-12-17(13-7-14)33(28,29)32-21-18-4-2-3-5-19(18)30-22(27)20(21)15-8-10-16(11-9-15)31-23(24,25)26/h2-13H,1H3