2-(2,5-dimethylphenyl)-8-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2,5-dimethylphenyl)-8-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dimethylphenyl)-8-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(2,5-dimethylphenyl)-8-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dimethylphenyl)-8-ethylquinoline-4-carboxylic acid Traditional Name: 2-(2,5-dimethylphenyl)-8-ethyl-cinchoninic acid Formula: C20H19NO2 MolecularWeight: 305.37036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=C(C=CC(=C3)C)C

InChI

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