methyl 2-methyl-5-oxidanylidene-4-pyridin-4-yl-hexanoate

Systemtic Name: methyl 2-methyl-5-oxidanylidene-4-pyridin-4-yl-hexanoate Openeye Name: methyl 2-methyl-5-oxo-4-(4-pyridyl)hexanoate CAS Name: 2-methyl-5-oxo-4-pyridin-4-ylhexanoic acid methyl ester IUPAC Name: methyl 2-methyl-5-oxo-4-pyridin-4-ylhexanoate Traditional Name: 5-keto-2-methyl-4-(4-pyridyl)hexanoic acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=NC=C1)C(=O)C)C(=O)OC

Isomeric SMILES

CC(CC(C1=CC=NC=C1)C(=O)C)C(=O)OC

InChI

InChI=1S/C13H17NO3/c1-9(13(16)17-3)8-12(10(2)15)11-4-6-14-7-5-11/h4-7,9,12H,8H2,1-3H3