ethyl 4-(6-imidazol-1-ylpyridin-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(6-imidazol-1-ylpyridin-3-yl)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(6-imidazol-1-yl-3-pyridyl)-4-oxo-butanoate CAS Name: 4-[6-(1-imidazolyl)-3-pyridinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(6-imidazol-1-ylpyridin-3-yl)-4-oxobutanoate Traditional Name: 4-(6-imidazol-1-yl-3-pyridyl)-4-keto-butyric acid ethyl ester Formula: C14H15N3O3 MolecularWeight: 273.2872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=CN=C(C=C1)N2C=CN=C2

Isomeric SMILES

CCOC(=O)CCC(=O)C1=CN=C(C=C1)N2C=CN=C2

InChI

InChI=1S/C14H15N3O3/c1-2-20-14(19)6-4-12(18)11-3-5-13(16-9-11)17-8-7-15-10-17/h3,5,7-10H,2,4,6H2,1H3