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

Systemtic Name: (3E)-3-[2-[7-methyl-4-(4-methylphenyl)sulfonyloxy-6-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl]ethylidene]cyclopentane-1-carboxylate Openeye Name: (3E)-3-[2-[6-hydroxy-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]ethylidene]cyclopentanecarboxylate CAS Name: (3E)-3-[2-[6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]ethylidene]-1-cyclopentanecarboxylate IUPAC Name: (3E)-3-[2-[6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]ethylidene]cyclopentane-1-carboxylate Traditional Name: (3E)-3-[2-(6-hydroxy-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl)ethylidene]cyclopentanecarboxylate Formula: C24H23O8S- MolecularWeight: 471.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C3=C2C(=O)OC3)C)O)CC=C4CCC(C4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C3=C2C(=O)OC3)C)O)C/C=C/4\CCC(C4)C(=O)[O-]

InChI

InChI=1S/C24H24O8S/c1-13-3-8-17(9-4-13)33(29,30)32-22-18(10-6-15-5-7-16(11-15)23(26)27)21(25)14(2)19-12-31-24(28)20(19)22/h3-4,6,8-9,16,25H,5,7,10-12H2,1-2H3,(H,26,27)/p-1/b15-6+