Molecule ID: 4068592

IUPAC Name: 2-azaniumylethanesulfonate

Description: The molecule is the zwitterion formed from taurine by transfer of a proton from the sulfonyl to the amino group. It is the major species existing at physiological pH. It is a tautomer of a taurine.

SMILES: NCCS(=O)(=O)O

SELFIES: [N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O]

InChI: InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)

Molecular Properties:
- Polar Surface Area: 93.2 Ų
- LogP: -4.2