[5,7,8-trimethoxy-2-(4-methoxyphenyl)-6-oxidanyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [5,7,8-trimethoxy-2-(4-methoxyphenyl)-6-oxidanyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate Openeye Name: [6-hydroxy-5,7,8-trimethoxy-2-(4-methoxyphenyl)-4-oxo-chromen-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-hydroxy-5,7,8-trimethoxy-2-(4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-hydroxy-5,7,8-trimethoxy-2-(4-methoxyphenyl)-4-oxochromen-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [6-hydroxy-4-keto-5,7,8-trimethoxy-2-(4-methoxyphenyl)chromen-3-yl] ester Formula: C26H24O10S MolecularWeight: 528.52776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C(=C(C(=C3OC)OC)O)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C(=C(C(=C3OC)OC)O)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H24O10S/c1-14-6-12-17(13-7-14)37(29,30)36-25-19(27)18-22(32-3)20(28)24(33-4)26(34-5)23(18)35-21(25)15-8-10-16(31-2)11-9-15/h6-13,28H,1-5H3