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

Systemtic Name: 4-(heptan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(1-methylhexylsulfamoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(heptan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(heptan-2-ylsulfamoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(1-methylhexylsulfamoyl)-1H-pyrrole-2-carboxylic acid Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O4S/c1-3-4-5-6-9(2)14-19(17,18)10-7-11(12(15)16)13-8-10/h7-9,13-14H,3-6H2,1-2H3,(H,15,16)