2-pyridin-2-ylethyl 3-oxidanylidenebutanoate

Systemtic Name: 2-pyridin-2-ylethyl 3-oxidanylidenebutanoate Openeye Name: 2-(2-pyridyl)ethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 2-(2-pyridinyl)ethyl ester IUPAC Name: 2-pyridin-2-ylethyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 2-(2-pyridyl)ethyl ester Formula: C11H13NO3 MolecularWeight: 207.22582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCC1=CC=CC=N1

Isomeric SMILES

CC(=O)CC(=O)OCCC1=CC=CC=N1

InChI

InChI=1S/C11H13NO3/c1-9(13)8-11(14)15-7-5-10-4-2-3-6-12-10/h2-4,6H,5,7-8H2,1H3