prop-2-enyl 2-(4-methylpyrimidin-5-yl)carbonyl-3-oxidanylidene-pentanoate

Systemtic Name: prop-2-enyl 2-(4-methylpyrimidin-5-yl)carbonyl-3-oxidanylidene-pentanoate Openeye Name: allyl 2-(4-methylpyrimidine-5-carbonyl)-3-oxo-pentanoate CAS Name: 2-[(4-methyl-5-pyrimidinyl)-oxomethyl]-3-oxopentanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(4-methylpyrimidine-5-carbonyl)-3-oxopentanoate Traditional Name: 3-keto-2-(4-methylpyrimidine-5-carbonyl)valeric acid allyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(=O)C1=CN=CN=C1C)C(=O)OCC=C

Isomeric SMILES

CCC(=O)C(C(=O)C1=CN=CN=C1C)C(=O)OCC=C

InChI

InChI=1S/C14H16N2O4/c1-4-6-20-14(19)12(11(17)5-2)13(18)10-7-15-8-16-9(10)3/h4,7-8,12H,1,5-6H2,2-3H3