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

Systemtic Name: methyl 3-[3-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxidanylidene-1H-2-benzofuran-5-yl]cyclopenten-1-yl]propanoate Openeye Name: methyl 3-[3-[6-ethyl-7-methyl-3-oxo-4-(p-tolylsulfonyloxy)-1H-isobenzofuran-5-yl]cyclopenten-1-yl]propanoate CAS Name: 3-[3-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-isobenzofuran-5-yl]-1-cyclopentenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[6-ethyl-7-methyl-4-(4-methylphenyl)sulfonyloxy-3-oxo-1H-2-benzofuran-5-yl]cyclopenten-1-yl]propanoate Traditional Name: 3-[3-(6-ethyl-3-keto-7-methyl-4-tosyloxy-phthalan-5-yl)cyclopenten-1-yl]propionic acid methyl ester Formula: C27H30O7S MolecularWeight: 498.5879

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C1C3CCC(=C3)CCC(=O)OC)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

Isomeric SMILES

CCC1=C(C2=C(C(=C1C3CCC(=C3)CCC(=O)OC)OS(=O)(=O)C4=CC=C(C=C4)C)C(=O)OC2)C

InChI

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