6,6-dimethoxy-4,4-bis(oxidanyl)-3-(phenylcarbonyl)cyclohexene-1-sulfonic acid

Systemtic Name: 6,6-dimethoxy-4,4-bis(oxidanyl)-3-(phenylcarbonyl)cyclohexene-1-sulfonic acid Openeye Name: 3-benzoyl-4,4-dihydroxy-6,6-dimethoxy-cyclohexene-1-sulfonic acid CAS Name: 3-benzoyl-4,4-dihydroxy-6,6-dimethoxy-1-cyclohexenesulfonic acid IUPAC Name: 3-benzoyl-4,4-dihydroxy-6,6-dimethoxycyclohexene-1-sulfonic acid Traditional Name: 3-benzoyl-4,4-dihydroxy-6,6-dimethoxy-cyclohexene-1-sulfonic acid Formula: C15H18O8S MolecularWeight: 358.36362

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CC(C(C=C1S(=O)(=O)O)C(=O)C2=CC=CC=C2)(O)O)OC

Isomeric SMILES

COC1(CC(C(C=C1S(=O)(=O)O)C(=O)C2=CC=CC=C2)(O)O)OC

InChI

InChI=1S/C15H18O8S/c1-22-15(23-2)9-14(17,18)11(8-12(15)24(19,20)21)13(16)10-6-4-3-5-7-10/h3-8,11,17-18H,9H2,1-2H3,(H,19,20,21)