[6-fluoranyl-3-(4-methoxyphenyl)-2-oxidanylidene-chromen-4-yl] 4-methylbenzenesulfonate

Systemtic Name: [6-fluoranyl-3-(4-methoxyphenyl)-2-oxidanylidene-chromen-4-yl] 4-methylbenzenesulfonate Openeye Name: [6-fluoro-3-(4-methoxyphenyl)-2-oxo-chromen-4-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-fluoro-3-(4-methoxyphenyl)-2-oxo-1-benzopyran-4-yl] ester IUPAC Name: [6-fluoro-3-(4-methoxyphenyl)-2-oxochromen-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [6-fluoro-2-keto-3-(4-methoxyphenyl)chromen-4-yl] ester Formula: C23H17FO6S MolecularWeight: 440.440883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=C2C=C(C=C3)F)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)OC3=C2C=C(C=C3)F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H17FO6S/c1-14-3-10-18(11-4-14)31(26,27)30-22-19-13-16(24)7-12-20(19)29-23(25)21(22)15-5-8-17(28-2)9-6-15/h3-13H,1-2H3