2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl nitrate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl nitrate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl nitrate CAS Name: nitric acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl nitrate Traditional Name: nitric acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C9H8N2O6S MolecularWeight: 272.23462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCO[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CCO[N+](=O)[O-]

InChI

InChI=1S/C9H8N2O6S/c12-9-7-3-1-2-4-8(7)18(15,16)10(9)5-6-17-11(13)14/h1-4H,5-6H2