2,2,2-tris(fluoranyl)-N-(7-nitro-1-oxidanylidene-7H-1,2,4-benzotriazin-1-ium-3-yl)ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-(7-nitro-1-oxidanylidene-7H-1,2,4-benzotriazin-1-ium-3-yl)ethanamide Openeye Name: 2,2,2-trifluoro-N-(7-nitro-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-yl)acetamide CAS Name: 2,2,2-trifluoro-N-(7-nitro-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-yl)acetamide IUPAC Name: 2,2,2-trifluoro-N-(7-nitro-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-yl)acetamide Traditional Name: 2,2,2-trifluoro-N-(1-keto-7-nitro-7H-1,2,4-benzotriazin-1-ium-3-yl)acetamide Formula: C9H5F3N5O4+ MolecularWeight: 304.16231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=N[N+](=O)C2=CC1[N+](=O)[O-])NC(=O)C(F)(F)F

Isomeric SMILES

C1=CC2=NC(=N[N+](=O)C2=CC1[N+](=O)[O-])NC(=O)C(F)(F)F

InChI

InChI=1S/C9H4F3N5O4/c10-9(11,12)7(18)14-8-13-5-2-1-4(17(20)21)3-6(5)16(19)15-8/h1-4H/p+1