2-[5-cyano-3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]butanoic acid

Systemtic Name: 2-[5-cyano-3,6-dimethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]butanoic acid Openeye Name: 2-(5-cyano-3,6-dimethyl-2,4-dioxo-pyrimidin-1-yl)butanoic acid CAS Name: 2-(5-cyano-3,6-dimethyl-2,4-dioxo-1-pyrimidinyl)butanoic acid IUPAC Name: 2-(5-cyano-3,6-dimethyl-2,4-dioxopyrimidin-1-yl)butanoic acid Traditional Name: 2-(5-cyano-2,4-diketo-3,6-dimethyl-pyrimidin-1-yl)butyric acid Formula: C11H13N3O4 MolecularWeight: 251.23862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C(=C(C(=O)N(C1=O)C)C#N)C

Isomeric SMILES

CCC(C(=O)O)N1C(=C(C(=O)N(C1=O)C)C#N)C

InChI

InChI=1S/C11H13N3O4/c1-4-8(10(16)17)14-6(2)7(5-12)9(15)13(3)11(14)18/h8H,4H2,1-3H3,(H,16,17)