6-(azepan-1-yl)-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(azepan-1-yl)-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(azepan-1-yl)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-(1-azepanyl)-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(azepan-1-yl)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(azepan-1-yl)-5-nitro-1H-pyrimidin-4-one Formula: C10H14N4O3 MolecularWeight: 238.24316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=O)N=CN2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=O)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O3/c15-10-8(14(16)17)9(11-7-12-10)13-5-3-1-2-4-6-13/h7H,1-6H2,(H,11,12,15)