2-[3-[[6-methoxy-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]methyl]-1-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]-1-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]-1-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]-1-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]-1-methylcyclopent-2-en-1-yl]acetic acid Traditional Name: 2-[3-[(3-keto-6-methoxy-7-methyl-4-tosyloxy-phthalan-5-yl)methyl]-1-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=CC(CC4)(C)CC(=O)O

Isomeric SMILES

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

InChI

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