[1-oxidanylidene-1-(4-phenylmethoxyphenyl)propan-2-yl] 6-chloranyl-2-(2,4-dichlorophenyl)quinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(4-phenylmethoxyphenyl)propan-2-yl] 6-chloranyl-2-(2,4-dichlorophenyl)quinoline-4-carboxylate Openeye Name: [2-(4-benzyloxyphenyl)-1-methyl-2-oxo-ethyl] 6-chloro-2-(2,4-dichlorophenyl)quinoline-4-carboxylate CAS Name: 6-chloro-2-(2,4-dichlorophenyl)-4-quinolinecarboxylic acid [1-oxo-1-(4-phenylmethoxyphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylmethoxyphenyl)propan-2-yl] 6-chloro-2-(2,4-dichlorophenyl)quinoline-4-carboxylate Traditional Name: 6-chloro-2-(2,4-dichlorophenyl)cinchoninic acid [2-(4-benzoxyphenyl)-2-keto-1-methyl-ethyl] ester Formula: C32H22Cl3NO4 MolecularWeight: 590.88038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C32H22Cl3NO4/c1-19(31(37)21-7-11-24(12-8-21)39-18-20-5-3-2-4-6-20)40-32(38)27-17-30(25-13-9-23(34)16-28(25)35)36-29-14-10-22(33)15-26(27)29/h2-17,19H,18H2,1H3