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

Systemtic Name: 3-[4,6-dimethyl-1-(3-methylphenyl)-2-oxidanylidene-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4,6-dimethyl-1-(m-tolyl)-2-oxo-pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-1-(3-methylphenyl)-2-oxo-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-1-(3-methylphenyl)-2-oxopyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-keto-4,6-dimethyl-1-(m-tolyl)pyrimidin-5-yl]propionic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C(=NC2=O)C)CCC(=O)O)C

InChI

InChI=1S/C16H18N2O3/c1-10-5-4-6-13(9-10)18-12(3)14(7-8-15(19)20)11(2)17-16(18)21/h4-6,9H,7-8H2,1-3H3,(H,19,20)