N-Oleoyl-N-methyltaurine

CAS Registry Number®

97-80-3
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CAS Name

N-Oleoyl-N-methyltaurine

Molecular Formula

C21H41NO4S

Molecular Mass

403.62

Cite this Page

N-Oleoyl-N-methyltaurine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=97-80-3 (retrieved 2024-05-15) (CAS RN: 97-80-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H41NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(23)22(2)19-20-27(24,25)26/h10-11H,3-9,12-20H2,1-2H3,(H,24,25,26)/b11-10-

InChIKey

InChIKey=GXJQMKFJQFGQKV-KHPPLWFESA-N

SMILES

C(CCCCCCC/C=C\CCCCCCCC)(N(CCS(=O)(=O)O)C)=O

Canonical SMILES

O=C(N(C)CCS(=O)(=O)O)CCCCCCCC=CCCCCCCCC

Other Names for this Substance

  • Ethanesulfonic acid, 2-[methyl[(9Z)-1-oxo-9-octadecen-1-yl]amino]-
  • Taurine, N-methyl-N-oleoyl-
  • Ethanesulfonic acid, 2-[methyl(1-oxo-9-octadecenyl)amino]-, (Z)-
  • Ethanesulfonic acid, 2-[methyl[(9Z)-1-oxo-9-octadecenyl]amino]-
  • 2-[Methyl[(9Z)-1-oxo-9-octadecen-1-yl]amino]ethanesulfonic acid

Deleted or Replaced CAS Registry Numbers

11119-99-6, 14826-94-9, 86403-20-5

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