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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18N.Cl
Molecular Weight 247.763
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Benzyl-5-ethyl-2-methylpyridinium chloride

SMILES

[Cl-].CCC1=C[N+](CC2=CC=CC=C2)=C(C)C=C1

InChI

InChIKey=GUEPTLJJMZGRNU-UHFFFAOYSA-M
InChI=1S/C15H18N.ClH/c1-3-14-10-9-13(2)16(11-14)12-15-7-5-4-6-8-15;/h4-11H,3,12H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C15H18N
Molecular Weight 212.3101
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:31:25 GMT 2023
Edited
by admin
on Sat Dec 16 12:31:25 GMT 2023
Record UNII
7X7BP6BH6F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Benzyl-5-ethyl-2-methylpyridinium chloride
Systematic Name English
Pyridinium, 5-ethyl-2-methyl-1-(phenylmethyl)-, chloride
Systematic Name English
Pyridinium, 5-ethyl-2-methyl-1-(phenylmethyl)-, chloride (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
16205849
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
CAS
93893-74-4
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
299-666-5
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
FDA UNII
7X7BP6BH6F
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID4052762
Created by admin on Sat Dec 16 12:31:25 GMT 2023 , Edited by admin on Sat Dec 16 12:31:25 GMT 2023
PRIMARY
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