3-(4-methylpyridin-1-ium-1-yl)propane-1-sulfonic acid hydroxide

Systemtic Name: 3-(4-methylpyridin-1-ium-1-yl)propane-1-sulfonic acid hydroxide Openeye Name: 3-(4-methylpyridin-1-ium-1-yl)propane-1-sulfonic acid hydroxide CAS Name: 3-(4-methyl-1-pyridin-1-iumyl)-1-propanesulfonic acid hydroxide IUPAC Name: 3-(4-methylpyridin-1-ium-1-yl)propane-1-sulfonic acid hydroxide Traditional Name: 3-(4-methylpyridin-1-ium-1-yl)propane-1-sulfonic acid hydroxide Formula: C9H15NO4S MolecularWeight: 233.2847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CCCS(=O)(=O)O.[OH-]

Isomeric SMILES

CC1=CC=[N+](C=C1)CCCS(=O)(=O)O.[OH-]

InChI

InChI=1S/C9H13NO3S.H2O/c1-9-3-6-10(7-4-9)5-2-8-14(11,12)13;/h3-4,6-7H,2,5,8H2,1H3;1H2