ethyl 2-[(1-butyl-2-oxidanylidene-pyridin-4-yl)methyl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 2-[(1-butyl-2-oxidanylidene-pyridin-4-yl)methyl]-3-oxidanylidene-propanoate Openeye Name: ethyl 2-[(1-butyl-2-oxo-4-pyridyl)methyl]-3-oxo-propanoate CAS Name: 2-[(1-butyl-2-oxo-4-pyridinyl)methyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-[(1-butyl-2-oxopyridin-4-yl)methyl]-3-oxopropanoate Traditional Name: 2-[(1-butyl-2-keto-4-pyridyl)methyl]-3-keto-propionic acid ethyl ester Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC(=CC1=O)CC(C=O)C(=O)OCC

Isomeric SMILES

CCCCN1C=CC(=CC1=O)CC(C=O)C(=O)OCC

InChI

InChI=1S/C15H21NO4/c1-3-5-7-16-8-6-12(10-14(16)18)9-13(11-17)15(19)20-4-2/h6,8,10-11,13H,3-5,7,9H2,1-2H3