ethyl 2-(3-methylpyridin-4-yl)carbonyl-5-oxidanylidene-hexanoate

Systemtic Name: ethyl 2-(3-methylpyridin-4-yl)carbonyl-5-oxidanylidene-hexanoate Openeye Name: ethyl 2-(3-methylpyridine-4-carbonyl)-5-oxo-hexanoate CAS Name: 2-[(3-methyl-4-pyridinyl)-oxomethyl]-5-oxohexanoic acid ethyl ester IUPAC Name: ethyl 2-(3-methylpyridine-4-carbonyl)-5-oxohexanoate Traditional Name: 5-keto-2-(3-methylisonicotinoyl)hexanoic acid ethyl ester Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4/c1-4-20-15(19)13(6-5-11(3)17)14(18)12-7-8-16-9-10(12)2/h7-9,13H,4-6H2,1-3H3