quinolin-8-yl 2-(3,4-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: quinolin-8-yl 2-(3,4-dimethylphenyl)quinoline-4-carboxylate Openeye Name: 8-quinolyl 2-(3,4-dimethylphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4-dimethylphenyl)-4-quinolinecarboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2-(3,4-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4-dimethylphenyl)cinchoninic acid 8-quinolyl ester Formula: C27H20N2O2 MolecularWeight: 404.4599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=CC5=C4N=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OC4=CC=CC5=C4N=CC=C5)C

InChI

InChI=1S/C27H20N2O2/c1-17-12-13-20(15-18(17)2)24-16-22(21-9-3-4-10-23(21)29-24)27(30)31-25-11-5-7-19-8-6-14-28-26(19)25/h3-16H,1-2H3