ethyl 2-(2,6-dimethylpyridin-4-yl)carbonyl-5-oxidanylidene-hexanoate

Systemtic Name: ethyl 2-(2,6-dimethylpyridin-4-yl)carbonyl-5-oxidanylidene-hexanoate Openeye Name: ethyl 2-(2,6-dimethylpyridine-4-carbonyl)-5-oxo-hexanoate CAS Name: 2-[(2,6-dimethyl-4-pyridinyl)-oxomethyl]-5-oxohexanoic acid ethyl ester IUPAC Name: ethyl 2-(2,6-dimethylpyridine-4-carbonyl)-5-oxohexanoate Traditional Name: 2-(2,6-dimethylisonicotinoyl)-5-keto-hexanoic acid ethyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C)C(=O)C1=CC(=NC(=C1)C)C

Isomeric SMILES

CCOC(=O)C(CCC(=O)C)C(=O)C1=CC(=NC(=C1)C)C

InChI

InChI=1S/C16H21NO4/c1-5-21-16(20)14(7-6-12(4)18)15(19)13-8-10(2)17-11(3)9-13/h8-9,14H,5-7H2,1-4H3