2-(4-ethylphenyl)-3,6-dimethyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-ethylphenyl)-3,6-dimethyl-quinoline-4-carboxylate Openeye Name: 2-(4-ethylphenyl)-3,6-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-ethylphenyl)-3,6-dimethyl-4-quinolinecarboxylate IUPAC Name: 2-(4-ethylphenyl)-3,6-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-ethylphenyl)-3,6-dimethyl-cinchoninate Formula: C20H18NO2- MolecularWeight: 304.36242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)[O-])C

InChI

InChI=1S/C20H19NO2/c1-4-14-6-8-15(9-7-14)19-13(3)18(20(22)23)16-11-12(2)5-10-17(16)21-19/h5-11H,4H2,1-3H3,(H,22,23)/p-1