2-[6-azanyl-5-nitroso-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]pentanoic acid

Systemtic Name: 2-[6-azanyl-5-nitroso-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]pentanoic acid Openeye Name: 2-(6-amino-5-nitroso-2,4-dioxo-1H-pyrimidin-3-yl)pentanoic acid CAS Name: 2-(6-amino-5-nitroso-2,4-dioxo-1H-pyrimidin-3-yl)pentanoic acid IUPAC Name: 2-(6-amino-5-nitroso-2,4-dioxo-1H-pyrimidin-3-yl)pentanoic acid Traditional Name: 2-(6-amino-2,4-diketo-5-nitroso-1H-pyrimidin-3-yl)valeric acid Formula: C9H12N4O5 MolecularWeight: 256.21538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)N1C(=O)C(=C(NC1=O)N)N=O

Isomeric SMILES

CCCC(C(=O)O)N1C(=O)C(=C(NC1=O)N)N=O

InChI

InChI=1S/C9H12N4O5/c1-2-3-4(8(15)16)13-7(14)5(12-18)6(10)11-9(13)17/h4H,2-3,10H2,1H3,(H,11,17)(H,15,16)