4-methyl-5-oxidanylidene-4-pyridin-2-yl-hexanoic acid

Systemtic Name: 4-methyl-5-oxidanylidene-4-pyridin-2-yl-hexanoic acid Openeye Name: 4-methyl-5-oxo-4-(2-pyridyl)hexanoic acid CAS Name: 4-methyl-5-oxo-4-(2-pyridinyl)hexanoic acid IUPAC Name: 4-methyl-5-oxo-4-pyridin-2-ylhexanoic acid Traditional Name: 5-keto-4-methyl-4-(2-pyridyl)hexanoic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(CCC(=O)O)C1=CC=CC=N1

Isomeric SMILES

CC(=O)C(C)(CCC(=O)O)C1=CC=CC=N1

InChI

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