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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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