5-chloranyl-2H-benzotriazole-4-sulfonic acid

Systemtic Name: 5-chloranyl-2H-benzotriazole-4-sulfonic acid Openeye Name: 5-chloro-2H-benzotriazole-4-sulfonic acid CAS Name: 5-chloro-2H-benzotriazole-4-sulfonic acid IUPAC Name: 5-chloro-2H-benzotriazole-4-sulfonic acid Traditional Name: 5-chloro-2H-benzotriazole-4-sulfonic acid Formula: C6H4ClN3O3S MolecularWeight: 233.63226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C(=C1Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC2=NNN=C2C(=C1Cl)S(=O)(=O)O

InChI

InChI=1S/C6H4ClN3O3S/c7-3-1-2-4-5(9-10-8-4)6(3)14(11,12)13/h1-2H,(H,8,9,10)(H,11,12,13)