2,2-dimethylpropanoic acid; quinoline-2-carboxylic acid

Systemtic Name: 2,2-dimethylpropanoic acid; quinoline-2-carboxylic acid Openeye Name: 2,2-dimethylpropanoic acid; quinoline-2-carboxylic acid CAS Name: 2,2-dimethylpropanoic acid; 2-quinolinecarboxylic acid IUPAC Name: 2,2-dimethylpropanoic acid; quinoline-2-carboxylic acid Traditional Name: 2,2-dimethylpropionic acid; quinaldic acid Formula: C15H17NO4 MolecularWeight: 275.29978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)O.C1=CC=C2C(=C1)C=CC(=N2)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)O.C1=CC=C2C(=C1)C=CC(=N2)C(=O)O

InChI

InChI=1S/C10H7NO2.C5H10O2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9;1-5(2,3)4(6)7/h1-6H,(H,12,13);1-3H3,(H,6,7)