2-[(2E)-2-[2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]ethylidene]cyclopentyl]ethanoate

Systemtic Name: 2-[(2E)-2-[2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]ethylidene]cyclopentyl]ethanoate Openeye Name: 2-[(2E)-2-[2-[6-ethyl-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]ethylidene]cyclopentyl]acetate CAS Name: 2-[(2E)-2-[2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]ethylidene]cyclopentyl]acetate IUPAC Name: 2-[(2E)-2-[2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]ethylidene]cyclopentyl]acetate Traditional Name: 2-[(2E)-2-[2-(6-ethyl-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl)ethylidene]cyclopentyl]acetate Formula: C27H29O7S- MolecularWeight: 497.57996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C1CC=C3CCCC3CC(=O)[O-])OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

Isomeric SMILES

CCC1=C(C2=C(C(=C1C/C=C/3\CCCC3CC(=O)[O-])OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

InChI

InChI=1S/C27H30O7S/c1-4-21-17(3)23-15-33-27(30)25(23)26(34-35(31,32)20-11-8-16(2)9-12-20)22(21)13-10-18-6-5-7-19(18)14-24(28)29/h8-12,19H,4-7,13-15H2,1-3H3,(H,28,29)/p-1/b18-10+