2H-benzotriazol-5-ylmethanesulfonic acid

Systemtic Name: 2H-benzotriazol-5-ylmethanesulfonic acid Openeye Name: 2H-benzotriazol-5-ylmethanesulfonic acid CAS Name: 2H-benzotriazol-5-ylmethanesulfonic acid IUPAC Name: 2H-benzotriazol-5-ylmethanesulfonic acid Traditional Name: 2H-benzotriazol-5-ylmethanesulfonic acid Formula: C7H7N3O3S MolecularWeight: 213.21378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C=C1CS(=O)(=O)O

Isomeric SMILES

C1=CC2=NNN=C2C=C1CS(=O)(=O)O

InChI

InChI=1S/C7H7N3O3S/c11-14(12,13)4-5-1-2-6-7(3-5)9-10-8-6/h1-3H,4H2,(H,8,9,10)(H,11,12,13)