2H-benzotriazole; 2-sulfamoylbenzenesulfonic acid

Systemtic Name: 2H-benzotriazole; 2-sulfamoylbenzenesulfonic acid Openeye Name: 2H-benzotriazole; 2-sulfamoylbenzenesulfonic acid CAS Name: 2H-benzotriazole; 2-sulfamoylbenzenesulfonic acid IUPAC Name: 2H-benzotriazole; 2-sulfamoylbenzenesulfonic acid Traditional Name: 2H-benzotriazole; 2-sulfamoylbesylic acid Formula: C12H12N4O5S2 MolecularWeight: 356.37748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)S(=O)(=O)N)S(=O)(=O)O.C1=CC2=NNN=C2C=C1

Isomeric SMILES

C1=CC=C(C(=C1)S(=O)(=O)N)S(=O)(=O)O.C1=CC2=NNN=C2C=C1

InChI

InChI=1S/C6H5N3.C6H7NO5S2/c1-2-4-6-5(3-1)7-9-8-6;7-13(8,9)5-3-1-2-4-6(5)14(10,11)12/h1-4H,(H,7,8,9);1-4H,(H2,7,8,9)(H,10,11,12)