4-[4-[5-(4-methoxyphenyl)-5-oxidanylidene-pentoxy]phenyl]sulfonyloxane-4-carboxylic acid

Systemtic Name: 4-[4-[5-(4-methoxyphenyl)-5-oxidanylidene-pentoxy]phenyl]sulfonyloxane-4-carboxylic acid Openeye Name: 4-[4-[5-(4-methoxyphenyl)-5-oxo-pentoxy]phenyl]sulfonyltetrahydropyran-4-carboxylic acid CAS Name: 4-[4-[5-(4-methoxyphenyl)-5-oxopentoxy]phenyl]sulfonyl-4-oxanecarboxylic acid IUPAC Name: 4-[4-[5-(4-methoxyphenyl)-5-oxopentoxy]phenyl]sulfonyloxane-4-carboxylic acid Traditional Name: 4-[4-[5-keto-5-(4-methoxyphenyl)pentoxy]phenyl]sulfonyltetrahydropyran-4-carboxylic acid Formula: C24H28O8S MolecularWeight: 476.53932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CCCCOC2=CC=C(C=C2)S(=O)(=O)C3(CCOCC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CCCCOC2=CC=C(C=C2)S(=O)(=O)C3(CCOCC3)C(=O)O

InChI

InChI=1S/C24H28O8S/c1-30-19-7-5-18(6-8-19)22(25)4-2-3-15-32-20-9-11-21(12-10-20)33(28,29)24(23(26)27)13-16-31-17-14-24/h5-12H,2-4,13-17H2,1H3,(H,26,27)