4-(4-butoxyphenyl)sulfonyloxane-4-carboxylic acid

Systemtic Name: 4-(4-butoxyphenyl)sulfonyloxane-4-carboxylic acid Openeye Name: 4-(4-butoxyphenyl)sulfonyltetrahydropyran-4-carboxylic acid CAS Name: 4-(4-butoxyphenyl)sulfonyl-4-oxanecarboxylic acid IUPAC Name: 4-(4-butoxyphenyl)sulfonyloxane-4-carboxylic acid Traditional Name: 4-(4-butoxyphenyl)sulfonyltetrahydropyran-4-carboxylic acid Formula: C16H22O6S MolecularWeight: 342.40728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)C2(CCOCC2)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)C2(CCOCC2)C(=O)O

InChI

InChI=1S/C16H22O6S/c1-2-3-10-22-13-4-6-14(7-5-13)23(19,20)16(15(17)18)8-11-21-12-9-16/h4-7H,2-3,8-12H2,1H3,(H,17,18)