5-nitro-3-oxidanidyl-3-oxidanyl-2H-1,3-benzothiazol-3-ium 1-oxide

Systemtic Name: 5-nitro-3-oxidanidyl-3-oxidanyl-2H-1,3-benzothiazol-3-ium 1-oxide Openeye Name: 3-hydroxy-5-nitro-3-oxido-2H-1,3-benzothiazol-3-ium 1-oxide CAS Name: 3-hydroxy-5-nitro-3-oxido-2H-1,3-benzothiazol-3-ium 1-oxide IUPAC Name: 3-hydroxy-5-nitro-3-oxido-2H-1,3-benzothiazol-3-ium 1-oxide Traditional Name: 3-hydroxy-5-nitro-3-oxido-2H-1,3-benzothiazol-3-ium 1-oxide Formula: C7H6N2O5S MolecularWeight: 230.19794

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Descriptors Computed from Structure

Canonical SMILES:

C1[N+](C2=C(S1=O)C=CC(=C2)[N+](=O)[O-])(O)[O-]

Isomeric SMILES

C1[N+](C2=C(S1=O)C=CC(=C2)[N+](=O)[O-])(O)[O-]

InChI

InChI=1S/C7H6N2O5S/c10-8(11)5-1-2-7-6(3-5)9(12,13)4-15(7)14/h1-3,12H,4H2