cyclopentyl (Z)-2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]but-2-enoate

Systemtic Name: cyclopentyl (Z)-2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]but-2-enoate Openeye Name: cyclopentyl (Z)-2-[6-ethyl-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]but-2-enoate CAS Name: (Z)-2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]-2-butenoic acid cyclopentyl ester IUPAC Name: cyclopentyl (Z)-2-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]but-2-enoate Traditional Name: (Z)-2-(6-ethyl-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl)but-2-enoic acid cyclopentyl ester Formula: C27H30O7S MolecularWeight: 498.5879

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C1C(=CC)C(=O)OC3CCCC3)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

Isomeric SMILES

CCC1=C(C2=C(C(=C1/C(=C/C)/C(=O)OC3CCCC3)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

InChI

InChI=1S/C27H30O7S/c1-5-20-17(4)22-15-32-27(29)24(22)25(34-35(30,31)19-13-11-16(3)12-14-19)23(20)21(6-2)26(28)33-18-9-7-8-10-18/h6,11-14,18H,5,7-10,15H2,1-4H3/b21-6-