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

Systemtic Name: (3,4-dimethylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: (3,4-dimethylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-(3-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid (3,4-dimethylphenyl) ester Formula: C27H24ClNO2 MolecularWeight: 429.93796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24ClNO2/c1-15-11-18(4)25-23(12-15)24(27(30)31-22-10-9-16(2)17(3)13-22)19(5)26(29-25)20-7-6-8-21(28)14-20/h6-14H,1-5H3