[2-(4-methylphenyl)-2-oxidanylidene-ethyl] 8-chloranyl-2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: [2-(4-methylphenyl)-2-oxidanylidene-ethyl] 8-chloranyl-2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: [2-oxo-2-(p-tolyl)ethyl] 8-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-chlorophenyl)-4-quinolinecarboxylic acid [2-(4-methylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] 8-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(4-chlorophenyl)cinchoninic acid [2-keto-2-(p-tolyl)ethyl] ester Formula: C25H17Cl2NO3 MolecularWeight: 450.31338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H17Cl2NO3/c1-15-5-7-17(8-6-15)23(29)14-31-25(30)20-13-22(16-9-11-18(26)12-10-16)28-24-19(20)3-2-4-21(24)27/h2-13H,14H2,1H3