3-(1-methylpiperidin-1-ium-1-yl)propane-1-sulfonate

Systemtic Name: 3-(1-methylpiperidin-1-ium-1-yl)propane-1-sulfonate Openeye Name: 3-(1-methylpiperidin-1-ium-1-yl)propane-1-sulfonate CAS Name: 3-(1-methyl-1-piperidin-1-iumyl)-1-propanesulfonate IUPAC Name: 3-(1-methylpiperidin-1-ium-1-yl)propane-1-sulfonate Traditional Name: 3-(1-methylpiperidin-1-ium-1-yl)propane-1-sulfonate Formula: C9H19NO3S MolecularWeight: 221.31706

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCCS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCCCC1)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H19NO3S/c1-10(6-3-2-4-7-10)8-5-9-14(11,12)13/h2-9H2,1H3