4-[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]sulfonyloxane-4-carboxylic acid

Systemtic Name: 4-[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]sulfonyloxane-4-carboxylic acid Openeye Name: 4-[4-(4-hydroxy-4-oxo-butoxy)phenyl]sulfonyltetrahydropyran-4-carboxylic acid CAS Name: 4-[4-(4-hydroxy-4-oxobutoxy)phenyl]sulfonyl-4-oxanecarboxylic acid IUPAC Name: 4-[4-(4-hydroxy-4-oxobutoxy)phenyl]sulfonyloxane-4-carboxylic acid Traditional Name: 4-[4-(4-hydroxy-4-keto-butoxy)phenyl]sulfonyltetrahydropyran-4-carboxylic acid Formula: C16H20O8S MolecularWeight: 372.3902

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCCCC(=O)O

Isomeric SMILES

C1COCCC1(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCCCC(=O)O

InChI

InChI=1S/C16H20O8S/c17-14(18)2-1-9-24-12-3-5-13(6-4-12)25(21,22)16(15(19)20)7-10-23-11-8-16/h3-6H,1-2,7-11H2,(H,17,18)(H,19,20)