[methyl-[4-[(4-sulfamoylphenyl)diazenyl]phenyl]amino]methanesulfonic acid

Systemtic Name: [methyl-[4-[(4-sulfamoylphenyl)diazenyl]phenyl]amino]methanesulfonic acid Openeye Name: [N-methyl-4-(4-sulfamoylphenyl)azo-anilino]methanesulfonic acid CAS Name: [N-methyl-4-(4-sulfamoylphenyl)azoanilino]methanesulfonic acid IUPAC Name: [N-methyl-4-[(4-sulfamoylphenyl)diazenyl]anilino]methanesulfonic acid Traditional Name: [N-methyl-4-(4-sulfamoylphenyl)azo-anilino]methanesulfonic acid Formula: C14H16N4O5S2 MolecularWeight: 384.43064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CS(=O)(=O)O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CN(CS(=O)(=O)O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C14H16N4O5S2/c1-18(10-24(19,20)21)13-6-2-11(3-7-13)16-17-12-4-8-14(9-5-12)25(15,22)23/h2-9H,10H2,1H3,(H2,15,22,23)(H,19,20,21)