3-(2,4-dimethoxypyrimidin-5-yl)-1-(4-methylphenyl)prop-2-yn-1-one

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(4-methylphenyl)prop-2-yn-1-one Openeye Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(p-tolyl)prop-2-yn-1-one CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-1-(4-methylphenyl)-2-propyn-1-one IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(4-methylphenyl)prop-2-yn-1-one Traditional Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(p-tolyl)prop-2-yn-1-one Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C#CC2=CN=C(N=C2OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C#CC2=CN=C(N=C2OC)OC

InChI

InChI=1S/C16H14N2O3/c1-11-4-6-12(7-5-11)14(19)9-8-13-10-17-16(21-3)18-15(13)20-2/h4-7,10H,1-3H3