6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 6-nitro-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 6-nitro-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 6-nitro-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 6-nitro-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-6-nitro-1,2-benzothiazol-3-one Formula: C7H4N2O5S MolecularWeight: 228.18206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=O

InChI

InChI=1S/C7H4N2O5S/c10-7-5-2-1-4(9(11)12)3-6(5)15(13,14)8-7/h1-3H,(H,8,10)