[4-[bis(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl] methanesulfonate

Systemtic Name: [4-[bis(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]phenyl] methanesulfonate Openeye Name: [4-[bis(2-hydroxy-4-oxo-chromen-3-yl)methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[bis(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]phenyl] ester IUPAC Name: [4-[bis(2-hydroxy-4-oxochromen-3-yl)methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[bis(2-hydroxy-4-keto-chromen-3-yl)methyl]phenyl] ester Formula: C26H18O9S MolecularWeight: 506.48072

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(OC5=CC=CC=C5C4=O)O

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(OC5=CC=CC=C5C4=O)O

InChI

InChI=1S/C26H18O9S/c1-36(31,32)35-15-12-10-14(11-13-15)20(21-23(27)16-6-2-4-8-18(16)33-25(21)29)22-24(28)17-7-3-5-9-19(17)34-26(22)30/h2-13,20,29-30H,1H3