5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]thiophene-3-carboxylate

Systemtic Name: 5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]thiophene-3-carboxylate Openeye Name: 5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]thiophene-3-carboxylate CAS Name: 5-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylsulfamoyl]-3-thiophenecarboxylate IUPAC Name: 5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]thiophene-3-carboxylate Traditional Name: 5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-3-thenoate Formula: C12H18N2O4S2 MolecularWeight: 318.41232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNS(=O)(=O)C2=CC(=CS2)C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNS(=O)(=O)C2=CC(=CS2)C(=O)[O-]

InChI

InChI=1S/C12H18N2O4S2/c1-2-14-5-3-4-10(14)7-13-20(17,18)11-6-9(8-19-11)12(15)16/h6,8,10,13H,2-5,7H2,1H3,(H,15,16)/t10-/m0/s1