ethyl 4-imidazol-1-yl-2-oxidanylidene-butanoate

Systemtic Name: ethyl 4-imidazol-1-yl-2-oxidanylidene-butanoate Openeye Name: ethyl 4-imidazol-1-yl-2-oxo-butanoate CAS Name: 4-(1-imidazolyl)-2-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-imidazol-1-yl-2-oxobutanoate Traditional Name: 4-imidazol-1-yl-2-keto-butyric acid ethyl ester Formula: C9H12N2O3 MolecularWeight: 196.20318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)CCN1C=CN=C1

Isomeric SMILES

CCOC(=O)C(=O)CCN1C=CN=C1

InChI

InChI=1S/C9H12N2O3/c1-2-14-9(13)8(12)3-5-11-6-4-10-7-11/h4,6-7H,2-3,5H2,1H3