(1S,2R)-2-[[4-(dimethylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-[[4-(dimethylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[[4-(dimethylsulfamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[[4-(dimethylsulfamoyl)anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[[4-(dimethylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[[4-(dimethylsulfamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O

InChI

InChI=1S/C16H22N2O5S/c1-18(2)24(22,23)12-9-7-11(8-10-12)17-15(19)13-5-3-4-6-14(13)16(20)21/h7-10,13-14H,3-6H2,1-2H3,(H,17,19)(H,20,21)/t13-,14+/m1/s1