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

Systemtic Name: (2-ethanoylphenyl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: (2-acetylphenyl) 3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid (2-acetylphenyl) ester IUPAC Name: (2-acetylphenyl) 3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-(p-tolyl)cinchoninic acid (2-acetylphenyl) ester Formula: C28H25NO3 MolecularWeight: 423.503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OC4=CC=CC=C4C(=O)C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2C)C(=O)OC4=CC=CC=C4C(=O)C)C)C

InChI

InChI=1S/C28H25NO3/c1-16-10-12-21(13-11-16)27-19(4)25(23-15-17(2)14-18(3)26(23)29-27)28(31)32-24-9-7-6-8-22(24)20(5)30/h6-15H,1-5H3