2-[(4-butan-2-ylphenyl)sulfonyloxymethyl]-2-methyl-3-oxidanylidene-butanoic acid

Systemtic Name: 2-[(4-butan-2-ylphenyl)sulfonyloxymethyl]-2-methyl-3-oxidanylidene-butanoic acid Openeye Name: 2-methyl-3-oxo-2-[(4-sec-butylphenyl)sulfonyloxymethyl]butanoic acid CAS Name: 2-[(4-butan-2-ylphenyl)sulfonyloxymethyl]-2-methyl-3-oxobutanoic acid IUPAC Name: 2-[(4-butan-2-ylphenyl)sulfonyloxymethyl]-2-methyl-3-oxobutanoic acid Traditional Name: 3-keto-2-methyl-2-[(4-sec-butylphenyl)sulfonyloxymethyl]butyric acid Formula: C16H22O6S MolecularWeight: 342.40728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)OCC(C)(C(=O)C)C(=O)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)OCC(C)(C(=O)C)C(=O)O

InChI

InChI=1S/C16H22O6S/c1-5-11(2)13-6-8-14(9-7-13)23(20,21)22-10-16(4,12(3)17)15(18)19/h6-9,11H,5,10H2,1-4H3,(H,18,19)