ethyl 5-butyl-4-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-butyl-4-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-butyl-4-oxo-1H-pyridine-3-carboxylate CAS Name: 5-butyl-4-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-butyl-4-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-butyl-4-keto-1H-pyridine-3-carboxylic acid ethyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CNC=C(C1=O)C(=O)OCC

Isomeric SMILES

CCCCC1=CNC=C(C1=O)C(=O)OCC

InChI

InChI=1S/C12H17NO3/c1-3-5-6-9-7-13-8-10(11(9)14)12(15)16-4-2/h7-8H,3-6H2,1-2H3,(H,13,14)