(2,6-dimethylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: (2,6-dimethylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: (2,6-dimethylphenyl) 2-(4-methoxyphenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-(4-methoxyphenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-6,8-dimethyl-cinchoninic acid (2,6-dimethylphenyl) ester Formula: C27H25NO3 MolecularWeight: 411.4923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)C2=CC(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25NO3/c1-16-13-19(4)25-22(14-16)23(27(29)31-26-17(2)7-6-8-18(26)3)15-24(28-25)20-9-11-21(30-5)12-10-20/h6-15H,1-5H3