ethyl 1-(2-ethylhexyl)-2-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: ethyl 1-(2-ethylhexyl)-2-oxidanylidene-pyridine-3-carboxylate Openeye Name: ethyl 1-(2-ethylhexyl)-2-oxo-pyridine-3-carboxylate CAS Name: 1-(2-ethylhexyl)-2-oxo-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-ethylhexyl)-2-oxopyridine-3-carboxylate Traditional Name: 1-(2-ethylhexyl)-2-keto-nicotinic acid ethyl ester Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN1C=CC=C(C1=O)C(=O)OCC

Isomeric SMILES

CCCCC(CC)CN1C=CC=C(C1=O)C(=O)OCC

InChI

InChI=1S/C16H25NO3/c1-4-7-9-13(5-2)12-17-11-8-10-14(15(17)18)16(19)20-6-3/h8,10-11,13H,4-7,9,12H2,1-3H3