2-methoxy-3-oxidanyl-4,5-bis(phenylcarbonyl)benzenesulfonic acid

Systemtic Name: 2-methoxy-3-oxidanyl-4,5-bis(phenylcarbonyl)benzenesulfonic acid Openeye Name: 4,5-dibenzoyl-3-hydroxy-2-methoxy-benzenesulfonic acid CAS Name: 4,5-dibenzoyl-3-hydroxy-2-methoxybenzenesulfonic acid IUPAC Name: 4,5-dibenzoyl-3-hydroxy-2-methoxybenzenesulfonic acid Traditional Name: 4,5-dibenzoyl-3-hydroxy-2-methoxy-besylic acid Formula: C21H16O7S MolecularWeight: 412.41254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C21H16O7S/c1-28-21-16(29(25,26)27)12-15(18(22)13-8-4-2-5-9-13)17(20(21)24)19(23)14-10-6-3-7-11-14/h2-12,24H,1H3,(H,25,26,27)