[5-methoxy-2-(phenylcarbonyl)phenyl] 3,4-dimethoxybenzenesulfonate

Systemtic Name: [5-methoxy-2-(phenylcarbonyl)phenyl] 3,4-dimethoxybenzenesulfonate Openeye Name: (2-benzoyl-5-methoxy-phenyl) 3,4-dimethoxybenzenesulfonate CAS Name: 3,4-dimethoxybenzenesulfonic acid (2-benzoyl-5-methoxyphenyl) ester IUPAC Name: (2-benzoyl-5-methoxyphenyl) 3,4-dimethoxybenzenesulfonate Traditional Name: 3,4-dimethoxybenzenesulfonic acid (2-benzoyl-5-methoxy-phenyl) ester Formula: C22H20O7S MolecularWeight: 428.455

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H20O7S/c1-26-16-9-11-18(22(23)15-7-5-4-6-8-15)20(13-16)29-30(24,25)17-10-12-19(27-2)21(14-17)28-3/h4-14H,1-3H3