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

Systemtic Name: [6,7,8-trimethoxy-2-(3-methoxy-4-phenylmethoxy-phenyl)-5-oxidanyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate Openeye Name: [2-(4-benzyloxy-3-methoxy-phenyl)-5-hydroxy-6,7,8-trimethoxy-4-oxo-chromen-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-hydroxy-6,7,8-trimethoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [5-hydroxy-6,7,8-trimethoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-4-oxochromen-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-benzoxy-3-methoxy-phenyl)-5-hydroxy-4-keto-6,7,8-trimethoxy-chromen-3-yl] ester Formula: C33H30O11S MolecularWeight: 634.6497

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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)OC)O)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C(=C(C(=C3OC)OC)OC)O)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC

InChI

InChI=1S/C33H30O11S/c1-19-11-14-22(15-12-19)45(36,37)44-31-27(35)25-26(34)30(39-3)33(41-5)32(40-4)29(25)43-28(31)21-13-16-23(24(17-21)38-2)42-18-20-9-7-6-8-10-20/h6-17,34H,18H2,1-5H3