[1-(3,4-dichlorophenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] 2-chloranylbenzoate

Systemtic Name: [1-(3,4-dichlorophenyl)carbonyl-2,2,4-trimethyl-quinolin-6-yl] 2-chloranylbenzoate Openeye Name: [1-(3,4-dichlorobenzoyl)-2,2,4-trimethyl-6-quinolyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [1-[(3,4-dichlorophenyl)-oxomethyl]-2,2,4-trimethyl-6-quinolinyl] ester IUPAC Name: [1-(3,4-dichlorobenzoyl)-2,2,4-trimethylquinolin-6-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [1-(3,4-dichlorobenzoyl)-2,2,4-trimethyl-6-quinolyl] ester Formula: C26H20Cl3NO3 MolecularWeight: 500.8009

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC(=C(C=C4)Cl)Cl)(C)C

Isomeric SMILES

CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC(=C(C=C4)Cl)Cl)(C)C

InChI

InChI=1S/C26H20Cl3NO3/c1-15-14-26(2,3)30(24(31)16-8-10-21(28)22(29)12-16)23-11-9-17(13-19(15)23)33-25(32)18-6-4-5-7-20(18)27/h4-14H,1-3H3