2-piperidin-1-ium-1-ylpropane-2-sulfonate

Systemtic Name: 2-piperidin-1-ium-1-ylpropane-2-sulfonate Openeye Name: 2-piperidin-1-ium-1-ylpropane-2-sulfonate CAS Name: 2-(1-piperidin-1-iumyl)-2-propanesulfonate IUPAC Name: 2-piperidin-1-ium-1-ylpropane-2-sulfonate Traditional Name: 2-piperidin-1-ium-1-ylpropane-2-sulfonate Formula: C8H17NO3S MolecularWeight: 207.29048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)([NH+]1CCCCC1)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)([NH+]1CCCCC1)S(=O)(=O)[O-]

InChI

InChI=1S/C8H17NO3S/c1-8(2,13(10,11)12)9-6-4-3-5-7-9/h3-7H2,1-2H3,(H,10,11,12)