3-[2-(4-oxidanylidenebutanoyl)pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[2-(4-oxidanylidenebutanoyl)pyrimidin-5-yl]propanoic acid Openeye Name: 3-[2-(4-oxobutanoyl)pyrimidin-5-yl]propanoic acid CAS Name: 3-[2-(1,4-dioxobutyl)-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[2-(4-oxobutanoyl)pyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-(4-ketobutanoyl)pyrimidin-5-yl]propionic acid Formula: C11H12N2O4 MolecularWeight: 236.22398

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=N1)C(=O)CCC=O)CCC(=O)O

Isomeric SMILES

C1=C(C=NC(=N1)C(=O)CCC=O)CCC(=O)O

InChI

InChI=1S/C11H12N2O4/c14-5-1-2-9(15)11-12-6-8(7-13-11)3-4-10(16)17/h5-7H,1-4H2,(H,16,17)