[4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: [4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 6-chloranyl-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: [3-chloro-1-(4-chlorobenzoyl)propyl] 6-chloro-2-(4-methoxyphenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 6-chloro-2-(4-methoxyphenyl)-3-methyl-4-quinolinecarboxylic acid [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] ester IUPAC Name: [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] 6-chloro-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxylate Traditional Name: 6-chloro-2-(4-methoxyphenyl)-3-methyl-cinchoninic acid [3-chloro-1-(4-chlorobenzoyl)propyl] ester Formula: C28H22Cl3NO4 MolecularWeight: 542.83758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC(CCCl)C(=O)C3=CC=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC(CCCl)C(=O)C3=CC=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H22Cl3NO4/c1-16-25(28(34)36-24(13-14-29)27(33)18-3-7-19(30)8-4-18)22-15-20(31)9-12-23(22)32-26(16)17-5-10-21(35-2)11-6-17/h3-12,15,24H,13-14H2,1-2H3