2-methoxy-4-oxidanyl-5-(4-phenoxyphenyl)carbonyl-benzenesulfonic acid

Systemtic Name: 2-methoxy-4-oxidanyl-5-(4-phenoxyphenyl)carbonyl-benzenesulfonic acid Openeye Name: 4-hydroxy-2-methoxy-5-(4-phenoxybenzoyl)benzenesulfonic acid CAS Name: 4-hydroxy-2-methoxy-5-[oxo-(4-phenoxyphenyl)methyl]benzenesulfonic acid IUPAC Name: 4-hydroxy-2-methoxy-5-(4-phenoxybenzoyl)benzenesulfonic acid Traditional Name: 4-hydroxy-2-methoxy-5-(4-phenoxybenzoyl)besylic acid Formula: C20H16O7S MolecularWeight: 400.40184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)O)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C(=C1)O)C(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C20H16O7S/c1-26-18-12-17(21)16(11-19(18)28(23,24)25)20(22)13-7-9-15(10-8-13)27-14-5-3-2-4-6-14/h2-12,21H,1H3,(H,23,24,25)