4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NS(=O)(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NS(=O)(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C13H20N2O4S/c1-8-4-3-5-11(9(8)2)15-20(18,19)10-6-12(13(16)17)14-7-10/h6-9,11,14-15H,3-5H2,1-2H3,(H,16,17)/t8-,9+,11-/m0/s1