[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: [2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: [2-(2,4-dichlorophenyl)-2-oxo-ethyl] 2-(3,4-dimethylphenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(3,4-dimethylphenyl)-6-methyl-4-quinolinecarboxylic acid [2-(2,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2-oxoethyl] 2-(3,4-dimethylphenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(3,4-dimethylphenyl)-6-methyl-cinchoninic acid [2-(2,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C27H21Cl2NO3 MolecularWeight: 478.36654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)C3=C(C=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C27H21Cl2NO3/c1-15-4-9-24-21(10-15)22(13-25(30-24)18-6-5-16(2)17(3)11-18)27(32)33-14-26(31)20-8-7-19(28)12-23(20)29/h4-13H,14H2,1-3H3