1-[2-oxidanylidene-2-[[4-[(3-sulfamoylphenyl)carbamoyl]phenyl]amino]ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[[4-[(3-sulfamoylphenyl)carbamoyl]phenyl]amino]ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-[4-[(3-sulfamoylphenyl)carbamoyl]anilino]ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-oxo-2-[4-[oxo-(3-sulfamoylanilino)methyl]anilino]ethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-oxo-2-[4-[(3-sulfamoylphenyl)carbamoyl]anilino]ethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[4-[(3-sulfamoylphenyl)carbamoyl]anilino]ethyl]cyclohexanecarboxylic acid Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C22H25N3O6S/c23-32(30,31)18-6-4-5-17(13-18)25-20(27)15-7-9-16(10-8-15)24-19(26)14-22(21(28)29)11-2-1-3-12-22/h4-10,13H,1-3,11-12,14H2,(H,24,26)(H,25,27)(H,28,29)(H2,23,30,31)