4-[5-nitro-2,4-bis(oxidanylidene)pyrimidin-1-yl]butanoic acid

Systemtic Name: 4-[5-nitro-2,4-bis(oxidanylidene)pyrimidin-1-yl]butanoic acid Openeye Name: 4-(5-nitro-2,4-dioxo-pyrimidin-1-yl)butanoic acid CAS Name: 4-(5-nitro-2,4-dioxo-1-pyrimidinyl)butanoic acid IUPAC Name: 4-(5-nitro-2,4-dioxopyrimidin-1-yl)butanoic acid Traditional Name: 4-(2,4-diketo-5-nitro-pyrimidin-1-yl)butyric acid Formula: C8H9N3O6 MolecularWeight: 243.17356

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=O)N1CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=O)NC(=O)N1CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O6/c12-6(13)2-1-3-10-4-5(11(16)17)7(14)9-8(10)15/h4H,1-3H2,(H,12,13)(H,9,14,15)