4-(octan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(octan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(1-methylheptylsulfamoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(octan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(octan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(1-methylheptylsulfamoyl)-1H-pyrrole-2-carboxylic acid Formula: C13H22N2O4S MolecularWeight: 302.38978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NS(=O)(=O)C1=CNC(=C1)C(=O)O

Isomeric SMILES

CCCCCCC(C)NS(=O)(=O)C1=CNC(=C1)C(=O)O

InChI

InChI=1S/C13H22N2O4S/c1-3-4-5-6-7-10(2)15-20(18,19)11-8-12(13(16)17)14-9-11/h8-10,14-15H,3-7H2,1-2H3,(H,16,17)