[4-(2,2-dimethylbutanoyloxy)phenyl]-oxidanyl-methanesulfonic acid

Systemtic Name: [4-(2,2-dimethylbutanoyloxy)phenyl]-oxidanyl-methanesulfonic acid Openeye Name: [4-(2,2-dimethylbutanoyloxy)phenyl]-hydroxy-methanesulfonic acid CAS Name: [4-(2,2-dimethyl-1-oxobutoxy)phenyl]-hydroxymethanesulfonic acid IUPAC Name: [4-(2,2-dimethylbutanoyloxy)phenyl]-hydroxymethanesulfonic acid Traditional Name: [4-(2,2-dimethylbutanoyloxy)phenyl]-hydroxy-methanesulfonic acid Formula: C13H18O6S MolecularWeight: 302.34342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OC1=CC=C(C=C1)C(O)S(=O)(=O)O

Isomeric SMILES

CCC(C)(C)C(=O)OC1=CC=C(C=C1)C(O)S(=O)(=O)O

InChI

InChI=1S/C13H18O6S/c1-4-13(2,3)12(15)19-10-7-5-9(6-8-10)11(14)20(16,17)18/h5-8,11,14H,4H2,1-3H3,(H,16,17,18)