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

Systemtic Name: [8-methoxy-2-(4-methoxyphenyl)-5,6,7-tris(oxidanyl)-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate Openeye Name: [5,6,7-trihydroxy-8-methoxy-2-(4-methoxyphenyl)-4-oxo-chromen-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5,6,7-trihydroxy-8-methoxy-2-(4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [5,6,7-trihydroxy-8-methoxy-2-(4-methoxyphenyl)-4-oxochromen-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5,6,7-trihydroxy-4-keto-8-methoxy-2-(4-methoxyphenyl)chromen-3-yl] ester Formula: C24H20O10S MolecularWeight: 500.4746

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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)O)O)O)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)O)O)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H20O10S/c1-12-4-10-15(11-5-12)35(29,30)34-24-18(26)16-17(25)19(27)20(28)23(32-3)22(16)33-21(24)13-6-8-14(31-2)9-7-13/h4-11,25,27-28H,1-3H3