7,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: 7,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: 7,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 7,8-dimethyl-2-phenyl-4-quinolinecarboxylate IUPAC Name: 7,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 7,8-dimethyl-2-phenyl-cinchoninate Formula: C18H14NO2- MolecularWeight: 276.30926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C18H15NO2/c1-11-8-9-14-15(18(20)21)10-16(19-17(14)12(11)2)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,20,21)/p-1