1-methyl-4-[methyl(pyridin-1-ium-2-yl)sulfamoyl]pyrrole-2-carboxylate

Systemtic Name: 1-methyl-4-[methyl(pyridin-1-ium-2-yl)sulfamoyl]pyrrole-2-carboxylate Openeye Name: 1-methyl-4-[methyl(pyridin-1-ium-2-yl)sulfamoyl]pyrrole-2-carboxylate CAS Name: 1-methyl-4-[methyl(2-pyridin-1-iumyl)sulfamoyl]-2-pyrrolecarboxylate IUPAC Name: 1-methyl-4-[methyl(pyridin-1-ium-2-yl)sulfamoyl]pyrrole-2-carboxylate Traditional Name: 1-methyl-4-[methyl(pyridin-1-ium-2-yl)sulfamoyl]pyrrole-2-carboxylate Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N(C)C2=CC=CC=[NH+]2

Isomeric SMILES

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N(C)C2=CC=CC=[NH+]2

InChI

InChI=1S/C12H13N3O4S/c1-14-8-9(7-10(14)12(16)17)20(18,19)15(2)11-5-3-4-6-13-11/h3-8H,1-2H3,(H,16,17)