2-Hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosen-1-yl]amino]propyl]-3-sulfo-1-propanaminium inner salt
CAS Registry Number®
164118-71-2
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CAS Name
2-Hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosen-1-yl]amino]propyl]-3-sulfo-1-propanaminium inner saltMolecular Formula
C30H60N2O5SCite this Page
2-Hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosen-1-yl]amino]propyl]-3-sulfo-1-propanaminium inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=164118-71-2 (retrieved ) (CAS RN: 164118-71-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1/C30H60N2O5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-30(34)31-25-23-26-32(2,3)27-29(33)28-38(35,36)37/h11-12,29,33H,4-10,13-28H2,1-3H3,(H-,31,34,35,36,37)/b12-11-
InChIKey
InChIKey=ONYHQNURMVNRJZ-QXMHVHEDNA-N
SMILES
C(CCNC(CCCCCCCCCCC/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-])CCCCCCCCCCCC=CCCCCCCCC
Other Names for this Substance
- 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosen-1-yl]amino]propyl]-3-sulfo-, inner salt
- 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[(1-oxo-13-docosenyl)amino]propyl]-3-sulfo-, inner salt, (Z)-
- 1-Propanaminium, 2-hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosenyl]amino]propyl]-3-sulfo-, inner salt
- 2-Hydroxy-N,N-dimethyl-N-[3-[[(13Z)-1-oxo-13-docosen-1-yl]amino]propyl]-3-sulfo-1-propanaminium inner salt
- Crosultaine E 30
Deleted or Replaced CAS Registry Numbers
250140-88-6, 2555038-47-4
