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

Systemtic Name: [2-methoxy-4-[8-methoxy-5-(2-methoxyethoxymethoxy)-6,7-bis(methoxymethoxy)-3-oxidanyl-4-oxidanylidene-chromen-2-yl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[3-hydroxy-8-methoxy-5-(2-methoxyethoxymethoxy)-6,7-bis(methoxymethoxy)-4-oxo-chromen-2-yl]-2-methoxy-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[3-hydroxy-8-methoxy-5-(2-methoxyethoxymethoxy)-6,7-bis(methoxymethoxy)-4-oxo-1-benzopyran-2-yl]-2-methoxyphenyl] ester IUPAC Name: [4-[3-hydroxy-8-methoxy-5-(2-methoxyethoxymethoxy)-6,7-bis(methoxymethoxy)-4-oxochromen-2-yl]-2-methoxyphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[3-hydroxy-4-keto-8-methoxy-5-(2-methoxyethoxymethoxy)-6,7-bis(methoxymethoxy)chromen-2-yl]-2-methoxy-phenyl] ester Formula: C32H36O15S MolecularWeight: 692.68424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C3=C(C(=O)C4=C(O3)C(=C(C(=C4OCOCCOC)OCOC)OCOC)OC)O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C3=C(C(=O)C4=C(O3)C(=C(C(=C4OCOCCOC)OCOC)OCOC)OC)O)OC

InChI

InChI=1S/C32H36O15S/c1-19-7-10-21(11-8-19)48(35,36)47-22-12-9-20(15-23(22)40-5)27-26(34)25(33)24-28(45-18-42-14-13-37-2)31(43-16-38-3)32(44-17-39-4)30(41-6)29(24)46-27/h7-12,15,34H,13-14,16-18H2,1-6H3