2-[3-[[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]methyl]-2-methyl-cyclopent-2-en-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]methyl]-2-methyl-cyclopent-2-en-1-yl]ethanoic acid Openeye Name: 2-[3-[[6-methoxy-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]methyl]-2-methyl-cyclopent-2-en-1-yl]acetic acid CAS Name: 2-[3-[[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]methyl]-2-methyl-1-cyclopent-2-enyl]acetic acid IUPAC Name: 2-[3-[[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]methyl]-2-methylcyclopent-2-en-1-yl]acetic acid Traditional Name: 2-[3-[(3-keto-6-methoxy-7-methyl-4-tosyloxy-phthalan-5-yl)methyl]-2-methyl-cyclopent-2-en-1-yl]acetic acid Formula: C26H28O8S MolecularWeight: 500.56072

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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)CC4=C(C(CC4)CC(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=C(C3=C2C(=O)OC3)C)OC)CC4=C(C(CC4)CC(=O)O)C

InChI

InChI=1S/C26H28O8S/c1-14-5-9-19(10-6-14)35(30,31)34-25-20(11-17-7-8-18(15(17)2)12-22(27)28)24(32-4)16(3)21-13-33-26(29)23(21)25/h5-6,9-10,18H,7-8,11-13H2,1-4H3,(H,27,28)