2-[[4-bromanyl-3-(cyclohexylsulfamoyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-bromanyl-3-(cyclohexylsulfamoyl)phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-bromo-3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid CAS Name: 2-[[[4-bromo-3-(cyclohexylsulfamoyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-bromo-3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid Traditional Name: 2-[[4-bromo-3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)Br

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)Br

InChI

InChI=1S/C20H21BrN2O5S/c21-16-11-10-13(19(24)22-17-9-5-4-8-15(17)20(25)26)12-18(16)29(27,28)23-14-6-2-1-3-7-14/h4-5,8-12,14,23H,1-3,6-7H2,(H,22,24)(H,25,26)