3-[4,6-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[4,6-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4,6-dimethyl-1-(5-methylisoxazol-3-yl)-2-oxo-pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-1-(5-methyl-3-isoxazolyl)-2-oxo-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)-2-oxopyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-keto-4,6-dimethyl-1-(5-methylisoxazol-3-yl)pyrimidin-5-yl]propionic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=NO1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

InChI

InChI=1S/C13H15N3O4/c1-7-6-11(15-20-7)16-9(3)10(4-5-12(17)18)8(2)14-13(16)19/h6H,4-5H2,1-3H3,(H,17,18)