4-chloranyl-5-[(2,4-dichlorophenyl)methylsulfamoyl]-2-(2-phenylbutylamino)benzoic acid

Systemtic Name: 4-chloranyl-5-[(2,4-dichlorophenyl)methylsulfamoyl]-2-(2-phenylbutylamino)benzoic acid Openeye Name: 4-chloro-5-[(2,4-dichlorophenyl)methylsulfamoyl]-2-(2-phenylbutylamino)benzoic acid CAS Name: 4-chloro-5-[(2,4-dichlorophenyl)methylsulfamoyl]-2-(2-phenylbutylamino)benzoic acid IUPAC Name: 4-chloro-5-[(2,4-dichlorophenyl)methylsulfamoyl]-2-(2-phenylbutylamino)benzoic acid Traditional Name: 4-chloro-5-[(2,4-dichlorobenzyl)sulfamoyl]-2-(2-phenylbutylamino)benzoic acid Formula: C24H23Cl3N2O4S MolecularWeight: 541.87442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)NCC2=C(C=C(C=C2)Cl)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC1=CC(=C(C=C1C(=O)O)S(=O)(=O)NCC2=C(C=C(C=C2)Cl)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C24H23Cl3N2O4S/c1-2-15(16-6-4-3-5-7-16)13-28-22-12-21(27)23(11-19(22)24(30)31)34(32,33)29-14-17-8-9-18(25)10-20(17)26/h3-12,15,28-29H,2,13-14H2,1H3,(H,30,31)