2-[1-(2-ethylphenyl)-4,6-dimethyl-2-oxidanylidene-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[1-(2-ethylphenyl)-4,6-dimethyl-2-oxidanylidene-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[1-(2-ethylphenyl)-4,6-dimethyl-2-oxo-pyrimidin-5-yl]acetic acid CAS Name: 2-[1-(2-ethylphenyl)-4,6-dimethyl-2-oxo-5-pyrimidinyl]acetic acid IUPAC Name: 2-[1-(2-ethylphenyl)-4,6-dimethyl-2-oxopyrimidin-5-yl]acetic acid Traditional Name: 2-[1-(2-ethylphenyl)-2-keto-4,6-dimethyl-pyrimidin-5-yl]acetic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=C(C(=NC2=O)C)CC(=O)O)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=C(C(=NC2=O)C)CC(=O)O)C

InChI

InChI=1S/C16H18N2O3/c1-4-12-7-5-6-8-14(12)18-11(3)13(9-15(19)20)10(2)17-16(18)21/h5-8H,4,9H2,1-3H3,(H,19,20)