methyl 4-methyl-3-oxidanylidene-5-pyridin-2-yl-pentanoate

Systemtic Name: methyl 4-methyl-3-oxidanylidene-5-pyridin-2-yl-pentanoate Openeye Name: methyl 4-methyl-3-oxo-5-(2-pyridyl)pentanoate CAS Name: 4-methyl-3-oxo-5-(2-pyridinyl)pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-3-oxo-5-pyridin-2-ylpentanoate Traditional Name: 3-keto-4-methyl-5-(2-pyridyl)valeric acid methyl ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=N1)C(=O)CC(=O)OC

Isomeric SMILES

CC(CC1=CC=CC=N1)C(=O)CC(=O)OC

InChI

InChI=1S/C12H15NO3/c1-9(11(14)8-12(15)16-2)7-10-5-3-4-6-13-10/h3-6,9H,7-8H2,1-2H3