4-methoxy-3-(2-methoxy-5-methoxysulfonyl-phenyl)carbonyl-benzenesulfonic acid

Systemtic Name: 4-methoxy-3-(2-methoxy-5-methoxysulfonyl-phenyl)carbonyl-benzenesulfonic acid Openeye Name: 4-methoxy-3-(2-methoxy-5-methoxysulfonyl-benzoyl)benzenesulfonic acid CAS Name: 4-methoxy-3-[(2-methoxy-5-methoxysulfonylphenyl)-oxomethyl]benzenesulfonic acid IUPAC Name: 4-methoxy-3-(2-methoxy-5-methoxysulfonylbenzoyl)benzenesulfonic acid Traditional Name: 4-methoxy-3-(2-methoxy-5-methoxysulfonyl-benzoyl)besylic acid Formula: C16H16O9S2 MolecularWeight: 416.42284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O9S2/c1-23-14-6-4-10(26(18,19)20)8-12(14)16(17)13-9-11(27(21,22)25-3)5-7-15(13)24-2/h4-9H,1-3H3,(H,18,19,20)