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

Systemtic Name: methyl 3-[3-[7-methyl-4-(4-methylphenyl)sulfonyloxy-6-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl]cyclopenten-1-yl]propanoate Openeye Name: methyl 3-[3-[6-hydroxy-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]cyclopenten-1-yl]propanoate CAS Name: 3-[3-[6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]-1-cyclopentenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[6-hydroxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]cyclopenten-1-yl]propanoate Traditional Name: 3-[3-(6-hydroxy-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl)cyclopenten-1-yl]propionic acid methyl ester Formula: C25H26O8S MolecularWeight: 486.53414

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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)C4CCC(=C4)CCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C3=C2C(=O)OC3)C)O)C4CCC(=C4)CCC(=O)OC

InChI

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