(4-methoxycarbonylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 6,8-dimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6,8-dimethyl-2-phenyl-4-quinolinecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 6,8-dimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 6,8-dimethyl-2-phenyl-cinchoninic acid (4-carbomethoxyphenyl) ester Formula: C26H21NO4 MolecularWeight: 411.44924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C(=O)OC)C

InChI

InChI=1S/C26H21NO4/c1-16-13-17(2)24-21(14-16)22(15-23(27-24)18-7-5-4-6-8-18)26(29)31-20-11-9-19(10-12-20)25(28)30-3/h4-15H,1-3H3