3-(diethylamino)-6-methyl-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-(diethylamino)-6-methyl-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-(diethylamino)-6-methyl-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-(diethylamino)-6-methyl-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-(diethylamino)-6-methyl-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-(diethylamino)-6-methyl-2-phenyl-cinchoninic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(N=C2C=CC(=CC2=C1C(=O)O)C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=C(N=C2C=CC(=CC2=C1C(=O)O)C)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-4-23(5-2)20-18(21(24)25)16-13-14(3)11-12-17(16)22-19(20)15-9-7-6-8-10-15/h6-13H,4-5H2,1-3H3,(H,24,25)