2-azanyl-6-[methyl(2-oxidanylidenepropyl)amino]-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 2-azanyl-6-[methyl(2-oxidanylidenepropyl)amino]-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-[acetonyl(methyl)amino]-2-amino-5-nitro-1H-pyrimidin-4-one CAS Name: 2-amino-6-[methyl(2-oxopropyl)amino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 2-amino-6-[methyl(2-oxopropyl)amino]-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-[acetonyl(methyl)amino]-2-amino-5-nitro-1H-pyrimidin-4-one Formula: C8H11N5O4 MolecularWeight: 241.20404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN(C)C1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CN(C)C1=C(C(=O)N=C(N1)N)[N+](=O)[O-]

InChI

InChI=1S/C8H11N5O4/c1-4(14)3-12(2)6-5(13(16)17)7(15)11-8(9)10-6/h3H2,1-2H3,(H3,9,10,11,15)