(2-ethanoylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (2-ethanoylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: (2-acetylphenyl) 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid (2-acetylphenyl) ester IUPAC Name: (2-acetylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-cinchoninic acid (2-acetylphenyl) ester Formula: C34H29NO4 MolecularWeight: 515.59836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=CC=C5C(=O)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)OC5=CC=CC=C5C(=O)C)C

InChI

InChI=1S/C34H29NO4/c1-21-18-22(2)32-29(19-21)31(34(37)39-30-13-9-8-12-28(30)24(4)36)23(3)33(35-32)26-14-16-27(17-15-26)38-20-25-10-6-5-7-11-25/h5-19H,20H2,1-4H3