4-[3-(diethylazaniumyl)propylsulfamoyl]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: 4-[3-(diethylazaniumyl)propylsulfamoyl]-1-methyl-pyrrole-2-carboxylate Openeye Name: 4-[3-(diethylammonio)propylsulfamoyl]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[3-(diethylammonio)propylsulfamoyl]-1-methyl-2-pyrrolecarboxylate IUPAC Name: 4-[3-(diethylazaniumyl)propylsulfamoyl]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[3-(diethylammonio)propylsulfamoyl]-1-methyl-pyrrole-2-carboxylate Formula: C13H23N3O4S MolecularWeight: 317.40442

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNS(=O)(=O)C1=CN(C(=C1)C(=O)[O-])C

Isomeric SMILES

CC[NH+](CC)CCCNS(=O)(=O)C1=CN(C(=C1)C(=O)[O-])C

InChI

InChI=1S/C13H23N3O4S/c1-4-16(5-2)8-6-7-14-21(19,20)11-9-12(13(17)18)15(3)10-11/h9-10,14H,4-8H2,1-3H3,(H,17,18)