2H-1,3-benzothiazol-3-ium 1,1,3-trioxide

Systemtic Name: 2H-1,3-benzothiazol-3-ium 1,1,3-trioxide Openeye Name: 2H-1,3-benzothiazol-3-ium 1,1,3-trioxide CAS Name: 2H-1,3-benzothiazol-3-ium 1,1,3-trioxide IUPAC Name: 2H-1,3-benzothiazol-3-ium 1,1,3-trioxide Traditional Name: 2H-1,3-benzothiazol-3-ium 1,1,3-trioxide Formula: C7H6NO3S+ MolecularWeight: 184.19244

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Descriptors Computed from Structure

Canonical SMILES:

C1[N+](=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

C1[N+](=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C7H6NO3S/c9-8-5-12(10,11)7-4-2-1-3-6(7)8/h1-4H,5H2/q+1