2-(4-methylphenyl)sulfonyl-4-(phenylsulfonyl)benzenesulfonate

Systemtic Name: 2-(4-methylphenyl)sulfonyl-4-(phenylsulfonyl)benzenesulfonate Openeye Name: 4-(benzenesulfonyl)-2-(p-tolylsulfonyl)benzenesulfonate CAS Name: 4-(benzenesulfonyl)-2-(4-methylphenyl)sulfonylbenzenesulfonate IUPAC Name: 4-(benzenesulfonyl)-2-(4-methylphenyl)sulfonylbenzenesulfonate Traditional Name: 4-besyl-2-tosyl-besylate Formula: C19H15O7S3- MolecularWeight: 451.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C19H16O7S3/c1-14-7-9-16(10-8-14)28(22,23)19-13-17(11-12-18(19)29(24,25)26)27(20,21)15-5-3-2-4-6-15/h2-13H,1H3,(H,24,25,26)/p-1