2-methoxy-5-(4-methoxy-2-oxidanyl-phenyl)carbonyl-4-oxidanyl-cyclohexa-2,5-diene-1,1-disulfonic acid

Systemtic Name: 2-methoxy-5-(4-methoxy-2-oxidanyl-phenyl)carbonyl-4-oxidanyl-cyclohexa-2,5-diene-1,1-disulfonic acid Openeye Name: 4-hydroxy-5-(2-hydroxy-4-methoxy-benzoyl)-2-methoxy-cyclohexa-2,5-diene-1,1-disulfonic acid CAS Name: 4-hydroxy-5-[(2-hydroxy-4-methoxyphenyl)-oxomethyl]-2-methoxycyclohexa-2,5-diene-1,1-disulfonic acid IUPAC Name: 4-hydroxy-5-(2-hydroxy-4-methoxybenzoyl)-2-methoxycyclohexa-2,5-diene-1,1-disulfonic acid Traditional Name: 4-hydroxy-5-(2-hydroxy-4-methoxy-benzoyl)-2-methoxy-cyclohexa-2,5-diene-1,1-disulfonic acid Formula: C15H16O11S2 MolecularWeight: 436.41094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2=CC(C(=CC2O)OC)(S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2=CC(C(=CC2O)OC)(S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C15H16O11S2/c1-25-8-3-4-9(11(16)5-8)14(18)10-7-15(27(19,20)21,28(22,23)24)13(26-2)6-12(10)17/h3-7,12,16-17H,1-2H3,(H,19,20,21)(H,22,23,24)