BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules 		Member of WWPDB

3-chloro-4-hydroxybenzenesulfonamide

3-chloro-4-hydroxybenzenesulfonamide bmse012346 - Data

3-chloro-4-hydroxybenzenesulfonamide synonyms

Wikipedia:

Graphical representations:

3-chloro-4-hydroxybenzenesulfonamide

View large 3D structure

Molecular Formula: C6H6ClNO3S

Natural Isotopic Abundance Mass: 207.63474

Mono-Isotopic Molecular Masses:

  • C12N14: 206.975691737
  • C13N14: 212.99582076500002
  • C12N15: 207.97272663
  • C13N15: 213.99285565800002

InChI string: InChI=1S/C6H6ClNO3S/c7-5-3-4(12(8,10)11)1-2-6(5)9/h1-3,9H,(H2,8,10,11)

IUPAC: b'3-chloro-4-hydroxybenzenesulfonamide'

EU-OPENSCREEN: EOS103093

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)