3-methyl-2-pyridin-3-ylcarbonyl-butanoic acid

Systemtic Name: 3-methyl-2-pyridin-3-ylcarbonyl-butanoic acid Openeye Name: 3-methyl-2-(pyridine-3-carbonyl)butanoic acid CAS Name: 3-methyl-2-[oxo(3-pyridinyl)methyl]butanoic acid IUPAC Name: 3-methyl-2-(pyridine-3-carbonyl)butanoic acid Traditional Name: 3-methyl-2-nicotinoyl-butyric acid Formula: C11H13NO3 MolecularWeight: 207.22582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1=CN=CC=C1)C(=O)O

Isomeric SMILES

CC(C)C(C(=O)C1=CN=CC=C1)C(=O)O

InChI

InChI=1S/C11H13NO3/c1-7(2)9(11(14)15)10(13)8-4-3-5-12-6-8/h3-7,9H,1-2H3,(H,14,15)