(2,5-dimethylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (2,5-dimethylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: (2,5-dimethylphenyl) 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-cinchoninic acid (2,5-dimethylphenyl) ester Formula: C34H31NO3 MolecularWeight: 501.61484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C34H31NO3/c1-21-11-12-23(3)30(19-21)38-34(36)31-25(5)33(35-32-24(4)17-22(2)18-29(31)32)27-13-15-28(16-14-27)37-20-26-9-7-6-8-10-26/h6-19H,20H2,1-5H3