[7-methyl-4-(4-methylphenyl)sulfonyloxy-6-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl] (E)-2-cyclopentylbut-2-enoate

Systemtic Name: [7-methyl-4-(4-methylphenyl)sulfonyloxy-6-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl] (E)-2-cyclopentylbut-2-enoate Openeye Name: [6-hydroxy-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl] (E)-2-cyclopentylbut-2-enoate CAS Name: (E)-2-cyclopentyl-2-butenoic acid [6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl] ester IUPAC Name: [6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl] (E)-2-cyclopentylbut-2-enoate Traditional Name: (E)-2-cyclopentylbut-2-enoic acid (6-hydroxy-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl) ester Formula: C25H26O8S MolecularWeight: 486.53414

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1CCCC1)C(=O)OC2=C(C3=C(COC3=O)C(=C2O)C)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

C/C=C(\C1CCCC1)/C(=O)OC2=C(C3=C(COC3=O)C(=C2O)C)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H26O8S/c1-4-18(16-7-5-6-8-16)24(27)32-23-21(26)15(3)19-13-31-25(28)20(19)22(23)33-34(29,30)17-11-9-14(2)10-12-17/h4,9-12,16,26H,5-8,13H2,1-3H3/b18-4+