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

Systemtic Name: (1S,2R)-2-[[4-(tert-butylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-[[4-(tert-butylsulfamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[[4-(tert-butylsulfamoyl)anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-[[4-(tert-butylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-[[4-(tert-butylsulfamoyl)phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5S/c1-18(2,3)20-26(24,25)13-10-8-12(9-11-13)19-16(21)14-6-4-5-7-15(14)17(22)23/h8-11,14-15,20H,4-7H2,1-3H3,(H,19,21)(H,22,23)/t14-,15+/m1/s1