[5-methyl-2,4-bis(phenylsulfonyl)phenyl] benzenesulfonate

Systemtic Name: [5-methyl-2,4-bis(phenylsulfonyl)phenyl] benzenesulfonate Openeye Name: [2,4-bis(benzenesulfonyl)-5-methyl-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2,4-bis(benzenesulfonyl)-5-methylphenyl] ester IUPAC Name: [2,4-bis(benzenesulfonyl)-5-methylphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid (2,4-dibesyl-5-methyl-phenyl) ester Formula: C25H20O7S3 MolecularWeight: 528.6171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H20O7S3/c1-19-17-23(32-35(30,31)22-15-9-4-10-16-22)25(34(28,29)21-13-7-3-8-14-21)18-24(19)33(26,27)20-11-5-2-6-12-20/h2-18H,1H3