5-(2-azanyl-4-sulfamoyl-phenyl)sulfonyl-2-methyl-benzenesulfonic acid

Systemtic Name: 5-(2-azanyl-4-sulfamoyl-phenyl)sulfonyl-2-methyl-benzenesulfonic acid Openeye Name: 5-(2-amino-4-sulfamoyl-phenyl)sulfonyl-2-methyl-benzenesulfonic acid CAS Name: 5-(2-amino-4-sulfamoylphenyl)sulfonyl-2-methylbenzenesulfonic acid IUPAC Name: 5-(2-amino-4-sulfamoylphenyl)sulfonyl-2-methylbenzenesulfonic acid Traditional Name: 5-(2-amino-4-sulfamoyl-phenyl)sulfonyl-2-methyl-besylic acid Formula: C13H14N2O7S3 MolecularWeight: 406.45446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N)N)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N)N)S(=O)(=O)O

InChI

InChI=1S/C13H14N2O7S3/c1-8-2-3-9(7-13(8)25(20,21)22)23(16,17)12-5-4-10(6-11(12)14)24(15,18)19/h2-7H,14H2,1H3,(H2,15,18,19)(H,20,21,22)