4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[2-(dimethylamino)-2-oxidanylidene-ethyl]-ethyl-sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[[2-(dimethylamino)-2-oxo-ethyl]-ethyl-sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[[2-(dimethylamino)-2-oxoethyl]-ethylsulfamoyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[[2-(dimethylamino)-2-oxoethyl]-ethylsulfamoyl]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[[2-(dimethylamino)-2-keto-ethyl]-ethyl-sulfamoyl]-1-methyl-pyrrole-2-carboxylic acid Formula: C12H19N3O5S MolecularWeight: 317.36136

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N(C)C)S(=O)(=O)C1=CN(C(=C1)C(=O)O)C

Isomeric SMILES

CCN(CC(=O)N(C)C)S(=O)(=O)C1=CN(C(=C1)C(=O)O)C

InChI

InChI=1S/C12H19N3O5S/c1-5-15(8-11(16)13(2)3)21(19,20)9-6-10(12(17)18)14(4)7-9/h6-7H,5,8H2,1-4H3,(H,17,18)