6-(butan-2-ylcarbamoyl)-2-methyl-pyridine-3-carboxylic acid

Systemtic Name: 6-(butan-2-ylcarbamoyl)-2-methyl-pyridine-3-carboxylic acid Openeye Name: 2-methyl-6-(sec-butylcarbamoyl)pyridine-3-carboxylic acid CAS Name: 6-[(butan-2-ylamino)-oxomethyl]-2-methyl-3-pyridinecarboxylic acid IUPAC Name: 6-(butan-2-ylcarbamoyl)-2-methylpyridine-3-carboxylic acid Traditional Name: 2-methyl-6-(sec-butylcarbamoyl)nicotinic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-4-7(2)13-11(15)10-6-5-9(12(16)17)8(3)14-10/h5-7H,4H2,1-3H3,(H,13,15)(H,16,17)