2-[4-(1-azabicyclo[2.2.2]octan-3-ylsulfamoyl)pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(1-azabicyclo[2.2.2]octan-3-ylsulfamoyl)pyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(quinuclidin-3-ylsulfamoyl)pyrazol-1-yl]acetic acid CAS Name: 2-[4-(1-azabicyclo[2.2.2]octan-3-ylsulfamoyl)-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(1-azabicyclo[2.2.2]octan-3-ylsulfamoyl)pyrazol-1-yl]acetic acid Traditional Name: 2-[4-(quinuclidin-3-ylsulfamoyl)pyrazol-1-yl]acetic acid Formula: C12H18N4O4S MolecularWeight: 314.36072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NS(=O)(=O)C3=CN(N=C3)CC(=O)O

Isomeric SMILES

C1CN2CCC1C(C2)NS(=O)(=O)C3=CN(N=C3)CC(=O)O

InChI

InChI=1S/C12H18N4O4S/c17-12(18)8-16-6-10(5-13-16)21(19,20)14-11-7-15-3-1-9(11)2-4-15/h5-6,9,11,14H,1-4,7-8H2,(H,17,18)