1-[(Z)-4-[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]but-2-en-2-yl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[(Z)-4-[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]but-2-en-2-yl]cyclopentane-1-carboxylic acid Openeye Name: 1-[(Z)-3-[6-methoxy-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]-1-methyl-prop-1-enyl]cyclopentanecarboxylic acid CAS Name: 1-[(Z)-4-[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]but-2-en-2-yl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[(Z)-4-[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]but-2-en-2-yl]cyclopentane-1-carboxylic acid Traditional Name: 1-[(Z)-3-(3-keto-6-methoxy-7-methyl-4-tosyloxy-phthalan-5-yl)-1-methyl-prop-1-enyl]cyclopentanecarboxylic acid Formula: C27H30O8S MolecularWeight: 514.5873

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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)OC)CC=C(C)C4(CCCC4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C3=C2C(=O)OC3)C)OC)C/C=C(/C)\C4(CCCC4)C(=O)O

InChI

InChI=1S/C27H30O8S/c1-16-7-10-19(11-8-16)36(31,32)35-24-20(12-9-17(2)27(26(29)30)13-5-6-14-27)23(33-4)18(3)21-15-34-25(28)22(21)24/h7-11H,5-6,12-15H2,1-4H3,(H,29,30)/b17-9-