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

Systemtic Name: 1-(2-chlorophenyl)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-yn-1-one Openeye Name: 1-(2-chlorophenyl)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-yn-1-one CAS Name: 1-(2-chlorophenyl)-3-(2,4-dimethoxy-5-pyrimidinyl)-2-propyn-1-one IUPAC Name: 1-(2-chlorophenyl)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-yn-1-one Traditional Name: 1-(2-chlorophenyl)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-yn-1-one Formula: C15H11ClN2O3 MolecularWeight: 302.71244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C#CC(=O)C2=CC=CC=C2Cl)OC

Isomeric SMILES

COC1=NC(=NC=C1C#CC(=O)C2=CC=CC=C2Cl)OC

InChI

InChI=1S/C15H11ClN2O3/c1-20-14-10(9-17-15(18-14)21-2)7-8-13(19)11-5-3-4-6-12(11)16/h3-6,9H,1-2H3