5-nitro-6-(pyridin-3-ylmethylamino)-1H-pyrimidin-4-one

Systemtic Name: 5-nitro-6-(pyridin-3-ylmethylamino)-1H-pyrimidin-4-one Openeye Name: 5-nitro-6-(3-pyridylmethylamino)-1H-pyrimidin-4-one CAS Name: 5-nitro-6-(3-pyridinylmethylamino)-1H-pyrimidin-4-one IUPAC Name: 5-nitro-6-(pyridin-3-ylmethylamino)-1H-pyrimidin-4-one Traditional Name: 5-nitro-6-(3-pyridylmethylamino)-1H-pyrimidin-4-one Formula: C10H9N5O3 MolecularWeight: 247.21016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=C(C(=O)N=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)CNC2=C(C(=O)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O3/c16-10-8(15(17)18)9(13-6-14-10)12-5-7-2-1-3-11-4-7/h1-4,6H,5H2,(H2,12,13,14,16)