6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-nitro-2-(4-nitrophenyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C11H6N6O5 MolecularWeight: 302.20254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=NC=C(C(=O)N3N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=NC=C(C(=O)N3N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H6N6O5/c18-10-8(17(21)22)5-12-11-13-9(14-15(10)11)6-1-3-7(4-2-6)16(19)20/h1-5H,(H,12,13,14)