3-(3H-indol-1-ium-1-yl)propane-1-sulfonic acid hydroxide

Systemtic Name: 3-(3H-indol-1-ium-1-yl)propane-1-sulfonic acid hydroxide Openeye Name: 3-(3H-indol-1-ium-1-yl)propane-1-sulfonic acid hydroxide CAS Name: 3-(3H-indol-1-ium-1-yl)-1-propanesulfonic acid hydroxide IUPAC Name: 3-(3H-indol-1-ium-1-yl)propane-1-sulfonic acid hydroxide Traditional Name: 3-(3H-indol-1-ium-1-yl)propane-1-sulfonic acid hydroxide Formula: C11H15NO4S MolecularWeight: 257.3061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=[N+](C2=CC=CC=C21)CCCS(=O)(=O)O.[OH-]

Isomeric SMILES

C1C=[N+](C2=CC=CC=C21)CCCS(=O)(=O)O.[OH-]

InChI

InChI=1S/C11H13NO3S.H2O/c13-16(14,15)9-3-7-12-8-6-10-4-1-2-5-11(10)12;/h1-2,4-5,8H,3,6-7,9H2;1H2