[5-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-4-propyl-chromen-7-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-4-propyl-chromen-7-yl] 4-methylbenzenesulfonate Openeye Name: [2-oxo-4-propyl-5-(p-tolylsulfonyloxy)chromen-7-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(4-methylphenyl)sulfonyloxy-2-oxo-4-propyl-1-benzopyran-7-yl] ester IUPAC Name: [5-(4-methylphenyl)sulfonyloxy-2-oxo-4-propylchromen-7-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-4-propyl-5-tosyloxy-chromen-7-yl) ester Formula: C26H24O8S2 MolecularWeight: 528.59396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=CC(=C12)OS(=O)(=O)C3=CC=C(C=C3)C)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=CC(=C12)OS(=O)(=O)C3=CC=C(C=C3)C)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H24O8S2/c1-4-5-19-14-25(27)32-23-15-20(33-35(28,29)21-10-6-17(2)7-11-21)16-24(26(19)23)34-36(30,31)22-12-8-18(3)9-13-22/h6-16H,4-5H2,1-3H3