4-[4-(4-methoxyphenyl)carbonyl-2,6-diphenyl-phenoxy]sulfonyl-2-oxidanyl-benzoic acid

Systemtic Name: 4-[4-(4-methoxyphenyl)carbonyl-2,6-diphenyl-phenoxy]sulfonyl-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[4-(4-methoxybenzoyl)-2,6-diphenyl-phenoxy]sulfonyl-benzoic acid CAS Name: 2-hydroxy-4-[4-[(4-methoxyphenyl)-oxomethyl]-2,6-diphenylphenoxy]sulfonylbenzoic acid IUPAC Name: 2-hydroxy-4-[4-(4-methoxybenzoyl)-2,6-diphenylphenoxy]sulfonylbenzoic acid Traditional Name: 2-hydroxy-4-(4-p-anisoyl-2,6-diphenyl-phenoxy)sulfonyl-benzoic acid Formula: C33H24O8S MolecularWeight: 580.60386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)C3=CC=CC=C3)OS(=O)(=O)C4=CC(=C(C=C4)C(=O)O)O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)C3=CC=CC=C3)OS(=O)(=O)C4=CC(=C(C=C4)C(=O)O)O)C5=CC=CC=C5

InChI

InChI=1S/C33H24O8S/c1-40-25-14-12-23(13-15-25)31(35)24-18-28(21-8-4-2-5-9-21)32(29(19-24)22-10-6-3-7-11-22)41-42(38,39)26-16-17-27(33(36)37)30(34)20-26/h2-20,34H,1H3,(H,36,37)