2-chloranyl-4-(4-methylphenoxy)-5-sulfamoyl-benzenesulfonate

Systemtic Name: 2-chloranyl-4-(4-methylphenoxy)-5-sulfamoyl-benzenesulfonate Openeye Name: 2-chloro-4-(4-methylphenoxy)-5-sulfamoyl-benzenesulfonate CAS Name: 2-chloro-4-(4-methylphenoxy)-5-sulfamoylbenzenesulfonate IUPAC Name: 2-chloro-4-(4-methylphenoxy)-5-sulfamoylbenzenesulfonate Traditional Name: 2-chloro-4-(4-methylphenoxy)-5-sulfamoyl-besylate Formula: C13H11ClNO6S2- MolecularWeight: 376.81254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)[O-])Cl

InChI

InChI=1S/C13H12ClNO6S2/c1-8-2-4-9(5-3-8)21-11-6-10(14)12(23(18,19)20)7-13(11)22(15,16)17/h2-7H,1H3,(H2,15,16,17)(H,18,19,20)/p-1