2-chloranyl-4-[methyl(phenyl)amino]-5-sulfamoyl-benzenesulfonic acid

Systemtic Name: 2-chloranyl-4-[methyl(phenyl)amino]-5-sulfamoyl-benzenesulfonic acid Openeye Name: 2-chloro-4-(N-methylanilino)-5-sulfamoyl-benzenesulfonic acid CAS Name: 2-chloro-4-(N-methylanilino)-5-sulfamoylbenzenesulfonic acid IUPAC Name: 2-chloro-4-(N-methylanilino)-5-sulfamoylbenzenesulfonic acid Traditional Name: 2-chloro-4-(N-methylanilino)-5-sulfamoyl-besylic acid Formula: C13H13ClN2O5S2 MolecularWeight: 376.83572

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)O)Cl

Isomeric SMILES

CN(C1=CC=CC=C1)C2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)O)Cl

InChI

InChI=1S/C13H13ClN2O5S2/c1-16(9-5-3-2-4-6-9)11-7-10(14)12(23(19,20)21)8-13(11)22(15,17)18/h2-8H,1H3,(H2,15,17,18)(H,19,20,21)