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2-azaniumyl-3-[5-nitro-2,4-bis(oxidanylidene)pyrimidin-1-yl]propanoate

2-azaniumyl-3-[5-nitro-2,4-bis(oxidanylidene)pyrimidin-1-yl]propanoate

Systemtic Name:2-azaniumyl-3-[5-nitro-2,4-bis(oxidanylidene)pyrimidin-1-yl]propanoate
Openeye Name:2-azaniumyl-3-(5-nitro-2,4-dioxo-pyrimidin-1-yl)propanoate
CAS Name:2-ammonio-3-(5-nitro-2,4-dioxo-1-pyrimidinyl)propanoate
IUPAC Name:2-azaniumyl-3-(5-nitro-2,4-dioxopyrimidin-1-yl)propanoate
Traditional Name:2-ammonio-3-(2,4-diketo-5-nitro-pyrimidin-1-yl)propionate
Formula: C7H8N4O6
MolecularWeight: 244.16162
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=O)N1CC(C(=O)[O-])[NH3+])[N+](=O)[O-]


Isomeric SMILES

C1=C(C(=O)NC(=O)N1CC(C(=O)[O-])[NH3+])[N+](=O)[O-]


InChI

InChI=1S/C7H8N4O6/c8-3(6(13)14)1-10-2-4(11(16)17)5(12)9-7(10)15/h2-3H,1,8H2,(H,13,14)(H,9,12,15)


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