ethyl 2-methyl-5-oxidanylidene-4-pyridin-4-yl-heptanoate

Systemtic Name: ethyl 2-methyl-5-oxidanylidene-4-pyridin-4-yl-heptanoate Openeye Name: ethyl 2-methyl-5-oxo-4-(4-pyridyl)heptanoate CAS Name: 2-methyl-5-oxo-4-pyridin-4-ylheptanoic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-oxo-4-pyridin-4-ylheptanoate Traditional Name: 5-keto-2-methyl-4-(4-pyridyl)enanthic acid ethyl ester Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO3/c1-4-14(17)13(12-6-8-16-9-7-12)10-11(3)15(18)19-5-2/h6-9,11,13H,4-5,10H2,1-3H3