[4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 8-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: [4-chloranyl-1-(4-chlorophenyl)-1-oxidanylidene-butan-2-yl] 8-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [3-chloro-1-(4-chlorobenzoyl)propyl] 2-(4-benzyloxyphenyl)-8-chloro-3-methyl-quinoline-4-carboxylate CAS Name: 8-chloro-3-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] ester IUPAC Name: [4-chloro-1-(4-chlorophenyl)-1-oxobutan-2-yl] 8-chloro-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-8-chloro-3-methyl-cinchoninic acid [3-chloro-1-(4-chlorobenzoyl)propyl] ester Formula: C34H26Cl3NO4 MolecularWeight: 618.93354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(=C1C(=O)OC(CCCl)C(=O)C3=CC=C(C=C3)Cl)C=CC=C2Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(N=C2C(=C1C(=O)OC(CCCl)C(=O)C3=CC=C(C=C3)Cl)C=CC=C2Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C34H26Cl3NO4/c1-21-30(34(40)42-29(18-19-35)33(39)24-10-14-25(36)15-11-24)27-8-5-9-28(37)32(27)38-31(21)23-12-16-26(17-13-23)41-20-22-6-3-2-4-7-22/h2-17,29H,18-20H2,1H3