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

Systemtic Name: (2-ethanoylphenyl) 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: (2-acetylphenyl) 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid (2-acetylphenyl) ester IUPAC Name: (2-acetylphenyl) 2-(4-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid (2-acetylphenyl) ester Formula: C27H22ClNO3 MolecularWeight: 443.92148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OC4=CC=CC=C4C(=O)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OC4=CC=CC=C4C(=O)C)C

InChI

InChI=1S/C27H22ClNO3/c1-15-13-16(2)25-22(14-15)24(17(3)26(29-25)19-9-11-20(28)12-10-19)27(31)32-23-8-6-5-7-21(23)18(4)30/h5-14H,1-4H3