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

Systemtic Name: [1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl] 6-chloranyl-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Openeye Name: [2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl] 2-(4-benzyloxyphenyl)-6-chloro-3-methyl-quinoline-4-carboxylate CAS Name: 6-chloro-3-methyl-2-(4-phenylmethoxyphenyl)-4-quinolinecarboxylic acid [1-(4-chlorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-1-oxopropan-2-yl] 6-chloro-3-methyl-2-(4-phenylmethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-benzoxyphenyl)-6-chloro-3-methyl-cinchoninic acid [2-(4-chlorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C33H25Cl2NO4 MolecularWeight: 570.4619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC(C)C(=O)C3=CC=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC(C)C(=O)C3=CC=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C33H25Cl2NO4/c1-20-30(33(38)40-21(2)32(37)24-8-12-25(34)13-9-24)28-18-26(35)14-17-29(28)36-31(20)23-10-15-27(16-11-23)39-19-22-6-4-3-5-7-22/h3-18,21H,19H2,1-2H3