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

Systemtic Name: 3-[4,6-dimethyl-1-(2-methylbutan-2-yl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[1-(1,1-dimethylpropyl)-4,6-dimethyl-2-oxo-pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-1-(2-methylbutan-2-yl)-2-oxo-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-1-(2-methylbutan-2-yl)-2-oxopyrimidin-5-yl]propanoic acid Traditional Name: 3-(1-tert-amyl-2-keto-4,6-dimethyl-pyrimidin-5-yl)propionic acid Formula: C14H22N2O3 MolecularWeight: 266.33608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N1C(=C(C(=NC1=O)C)CCC(=O)O)C

Isomeric SMILES

CCC(C)(C)N1C(=C(C(=NC1=O)C)CCC(=O)O)C

InChI

InChI=1S/C14H22N2O3/c1-6-14(4,5)16-10(3)11(7-8-12(17)18)9(2)15-13(16)19/h6-8H2,1-5H3,(H,17,18)