4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butanoate

Systemtic Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butanoate Openeye Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butanoate CAS Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butanoate IUPAC Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butanoate Traditional Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]butyrate Formula: C12H22NO4S- MolecularWeight: 276.37238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NS(=O)(=O)CCCC(=O)[O-]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NS(=O)(=O)CCCC(=O)[O-]

InChI

InChI=1S/C12H23NO4S/c1-9-5-3-6-11(10(9)2)13-18(16,17)8-4-7-12(14)15/h9-11,13H,3-8H2,1-2H3,(H,14,15)/p-1/t9-,10+,11-/m0/s1