2-[2-[3-(dimethylamino)phenyl]-2-oxidanylidene-ethyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-[3-(dimethylamino)phenyl]-2-oxidanylidene-ethyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-[3-(dimethylamino)phenyl]-2-oxo-ethyl]pyridine-3-carboxylic acid CAS Name: 2-[2-[3-(dimethylamino)phenyl]-2-oxoethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[3-(dimethylamino)phenyl]-2-oxoethyl]pyridine-3-carboxylic acid Traditional Name: 2-[2-[3-(dimethylamino)phenyl]-2-keto-ethyl]nicotinic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)CC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)CC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C16H16N2O3/c1-18(2)12-6-3-5-11(9-12)15(19)10-14-13(16(20)21)7-4-8-17-14/h3-9H,10H2,1-2H3,(H,20,21)