4-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: 4-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate Openeye Name: 4-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate CAS Name: 4-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylsulfamoyl]-1H-pyrrole-2-carboxylate IUPAC Name: 4-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate Formula: C12H19N3O4S MolecularWeight: 301.36196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O4S/c1-2-15-5-3-4-9(15)7-14-20(18,19)10-6-11(12(16)17)13-8-10/h6,8-9,13-14H,2-5,7H2,1H3,(H,16,17)/t9-/m0/s1