[4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 7,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 7,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [3-chloro-1-(4-chlorobenzoyl)propyl] 7,8-dimethyl-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 7,8-dimethyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] ester IUPAC Name: [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] 7,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 7,8-dimethyl-2-(p-tolyl)cinchoninic acid [3-chloro-1-(4-chlorobenzoyl)propyl] ester Formula: C29H25Cl2NO3 MolecularWeight: 506.4197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)C)C(=C2)C(=O)OC(CCCl)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)C)C(=C2)C(=O)OC(CCCl)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H25Cl2NO3/c1-17-4-7-20(8-5-17)25-16-24(23-13-6-18(2)19(3)27(23)32-25)29(34)35-26(14-15-30)28(33)21-9-11-22(31)12-10-21/h4-13,16,26H,14-15H2,1-3H3