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

Systemtic Name: 6-nitro-5-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 6-nitro-5-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 6-nitro-5-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 6-nitro-5-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 6-nitro-5-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C8H9N5O3 MolecularWeight: 223.18876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N2C(=N1)N=CN2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C(=O)N2C(=N1)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C8H9N5O3/c1-2-3-5-6(13(15)16)7(14)12-8(11-5)9-4-10-12/h4H,2-3H2,1H3,(H,9,10,11)