2-[(2,6-diethylphenyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[(2,6-diethylphenyl)amino]pyridine-3-carboxylic acid Openeye Name: 2-(2,6-diethylanilino)pyridine-3-carboxylic acid CAS Name: 2-(2,6-diethylanilino)-3-pyridinecarboxylic acid IUPAC Name: 2-(2,6-diethylanilino)pyridine-3-carboxylic acid Traditional Name: 2-(2,6-diethylanilino)nicotinic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-3-11-7-5-8-12(4-2)14(11)18-15-13(16(19)20)9-6-10-17-15/h5-10H,3-4H2,1-2H3,(H,17,18)(H,19,20)