1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(9Z)-1-oxo-9-octadecen-1-yl]amino]propyl]-3-sulfo-, inner salt

CAS Registry Number®

93941-94-7

CAS Name

1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(9Z)-1-oxo-9-octadecen-1-yl]amino]propyl]-3-sulfo-, inner salt

Molecular Formula

C26H52N2O5S

Cite this Page

1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(9Z)-1-oxo-9-octadecen-1-yl]amino]propyl]-3-sulfo-, inner salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=93941-94-7 (retrieved 2024-11-23) (CAS RN: 93941-94-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C26H52N2O5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-26(30)27-21-19-22-28(2,3)23-25(29)24-34(31,32)33/h11-12,25,29H,4-10,13-24H2,1-3H3,(H-,27,30,31,32,33)/b12-11-

InChIKey

InChIKey=CNIGBCBFYDWQHS-QXMHVHEDNA-N

SMILES

C(CCNC(CCCCCCC/C=C\CCCCCCCC)=O)[N+](CC(CS(=O)(=O)[O-])O)(C)C

Canonical SMILES

O=C(NCCC[N+](C)(C)CC(O)CS(=O)(=O)[O-])CCCCCCCC=CCCCCCCCC

Other Names for this Substance

  • 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(9Z)-1-oxo-9-octadecen-1-yl]amino]propyl]-3-sulfo-, inner salt
  • 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[(1-oxo-9-octadecenyl)amino]propyl]-3-sulfo-, hydroxide, inner salt, (Z)-
  • 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(9Z)-1-oxo-9-octadecenyl]amino]propyl]-3-sulfo-, inner salt
  • 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[(1-oxo-9-octadecenyl)amino]propyl]-3-sulfo-, inner salt, (Z)-

CAS INSIGHTSTM
Hourglass and a clock