6,6-dimethoxy-4-oxidanyl-3-(phenylcarbonyl)cyclohexa-1,4-diene-1-sulfonic acid

Systemtic Name: 6,6-dimethoxy-4-oxidanyl-3-(phenylcarbonyl)cyclohexa-1,4-diene-1-sulfonic acid Openeye Name: 3-benzoyl-4-hydroxy-6,6-dimethoxy-cyclohexa-1,4-diene-1-sulfonic acid CAS Name: 3-benzoyl-4-hydroxy-6,6-dimethoxy-1-cyclohexa-1,4-dienesulfonic acid IUPAC Name: 3-benzoyl-4-hydroxy-6,6-dimethoxycyclohexa-1,4-diene-1-sulfonic acid Traditional Name: 3-benzoyl-4-hydroxy-6,6-dimethoxy-cyclohexa-1,4-diene-1-sulfonic acid Formula: C15H16O7S MolecularWeight: 340.34834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16O7S/c1-21-15(22-2)9-12(16)11(8-13(15)23(18,19)20)14(17)10-6-4-3-5-7-10/h3-9,11,16H,1-2H3,(H,18,19,20)