[6-(propan-2-ylsulfamoyl)pyridin-2-yl] propane-1-sulfonate

Systemtic Name: [6-(propan-2-ylsulfamoyl)pyridin-2-yl] propane-1-sulfonate Openeye Name: [6-(isopropylsulfamoyl)-2-pyridyl] propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: [6-(propan-2-ylsulfamoyl)pyridin-2-yl] propane-1-sulfonate Traditional Name: propane-1-sulfonic acid [6-(isopropylsulfamoyl)-2-pyridyl] ester Formula: C11H18N2O5S2 MolecularWeight: 322.40102

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)OC1=NC(=CC=C1)S(=O)(=O)NC(C)C

Isomeric SMILES

CCCS(=O)(=O)OC1=NC(=CC=C1)S(=O)(=O)NC(C)C

InChI

InChI=1S/C11H18N2O5S2/c1-4-8-19(14,15)18-10-6-5-7-11(12-10)20(16,17)13-9(2)3/h5-7,9,13H,4,8H2,1-3H3