ethyl 4-oxidanylidene-4-(4-pyrimidin-2-ylphenyl)butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-(4-pyrimidin-2-ylphenyl)butanoate Openeye Name: ethyl 4-oxo-4-(4-pyrimidin-2-ylphenyl)butanoate CAS Name: 4-oxo-4-[4-(2-pyrimidinyl)phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-(4-pyrimidin-2-ylphenyl)butanoate Traditional Name: 4-keto-4-[4-(2-pyrimidyl)phenyl]butyric acid ethyl ester Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CC=C(C=C1)C2=NC=CC=N2

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CC=C(C=C1)C2=NC=CC=N2

InChI

InChI=1S/C16H16N2O3/c1-2-21-15(20)9-8-14(19)12-4-6-13(7-5-12)16-17-10-3-11-18-16/h3-7,10-11H,2,8-9H2,1H3