3-nitro-N-(5-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide

Systemtic Name: 3-nitro-N-(5-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Openeye Name: 3-nitro-N-(5-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide CAS Name: 3-nitro-N-(5-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide IUPAC Name: 3-nitro-N-(5-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)benzamide Traditional Name: N-(5-keto-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-3-nitro-benzamide Formula: C12H8N6O4 MolecularWeight: 300.22972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=O)N=C3N2NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC(=O)N=C3N2NC=N3

InChI

InChI=1S/C12H8N6O4/c19-10-5-9(17-12(16-10)13-6-14-17)15-11(20)7-2-1-3-8(4-7)18(21)22/h1-6H,(H,15,20)(H,13,14,16,19)