(2-methylphenyl) 2-chloranyl-4-phenoxy-5-sulfamoyl-benzenesulfonate

Systemtic Name: (2-methylphenyl) 2-chloranyl-4-phenoxy-5-sulfamoyl-benzenesulfonate Openeye Name: o-tolyl 2-chloro-4-phenoxy-5-sulfamoyl-benzenesulfonate CAS Name: 2-chloro-4-phenoxy-5-sulfamoylbenzenesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 2-chloro-4-phenoxy-5-sulfamoylbenzenesulfonate Traditional Name: 2-chloro-4-phenoxy-5-sulfamoyl-benzenesulfonic acid o-tolyl ester Formula: C19H16ClNO6S2 MolecularWeight: 453.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C(=C2)S(=O)(=O)N)OC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C(=C2)S(=O)(=O)N)OC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H16ClNO6S2/c1-13-7-5-6-10-16(13)27-29(24,25)18-12-19(28(21,22)23)17(11-15(18)20)26-14-8-3-2-4-9-14/h2-12H,1H3,(H2,21,22,23)