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Details

Stereochemistry ACHIRAL
Molecular Formula C25H46N
Molecular Weight 360.6394
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of CETALKONIUM

SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChIKey=QDYLMAYUEZBUFO-UHFFFAOYSA-N
InChI=1S/C25H46N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25/h17-19,21-22H,4-16,20,23-24H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C25H46N
Molecular Weight 360.6394
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:00:30 UTC 2023
Edited
by admin
on Fri Dec 15 16:00:30 UTC 2023
Record UNII
FHG725432Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CETALKONIUM
Common Name English
CETALKONIUM ION
Common Name English
BENZYLHEXADECYLDIMETHYLAMMONIUM
Systematic Name English
BENZENEMETHANAMINIUM, N-HEXADECYL, N,N-DIMETHYL-
Common Name English
CETALKONIUM CATION
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
Code System Code Type Description
WIKIPEDIA
Cetalkonium
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
NCI_THESAURUS
C83612
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
DRUG BANK
DB11583
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
CAS
10328-34-4
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
EVMPD
SUB07445MIG
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
EPA CompTox
DTXSID3047007
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
PUBCHEM
31203
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
FDA UNII
FHG725432Z
Created by admin on Fri Dec 15 16:00:30 UTC 2023 , Edited by admin on Fri Dec 15 16:00:30 UTC 2023
PRIMARY
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