U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H14N
Molecular Weight 184.257
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of N-Benzyl-3-methylpyridinium

SMILES

CC1=C[N+](CC2=CC=CC=C2)=CC=C1

InChI

InChIKey=KPLXPAJPJHQENL-UHFFFAOYSA-N
InChI=1S/C13H14N/c1-12-6-5-9-14(10-12)11-13-7-3-2-4-8-13/h2-10H,11H2,1H3/q+1

HIDE SMILES / InChI

Molecular Formula C13H14N
Molecular Weight 184.257
Charge 1
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 19:15:52 GMT 2023
Edited
by admin
on Sat Dec 16 19:15:52 GMT 2023
Record UNII
VZ95HHD9UM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-Benzyl-3-methylpyridinium
Common Name English
Pyridinium, 3-methyl-1-(phenylmethyl)-
Systematic Name English
1-Benzyl-3-picolinium
Systematic Name English
Code System Code Type Description
CAS
16183-86-1
Created by admin on Sat Dec 16 19:15:52 GMT 2023 , Edited by admin on Sat Dec 16 19:15:52 GMT 2023
PRIMARY
PUBCHEM
85334
Created by admin on Sat Dec 16 19:15:52 GMT 2023 , Edited by admin on Sat Dec 16 19:15:52 GMT 2023
PRIMARY
FDA UNII
VZ95HHD9UM
Created by admin on Sat Dec 16 19:15:52 GMT 2023 , Edited by admin on Sat Dec 16 19:15:52 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
IONIC MOIETY
SALT/SOLVATE -> PARENT