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Details

Stereochemistry RACEMIC
Molecular Formula C12H15NO
Molecular Weight 189.2536
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MPTP N-OXIDE

SMILES

C[N+]1([O-])CCC(=CC1)C2=CC=CC=C2

InChI

InChIKey=FZVSMNOAJGWONA-UHFFFAOYSA-N
InChI=1S/C12H15NO/c1-13(14)9-7-12(8-10-13)11-5-3-2-4-6-11/h2-7H,8-10H2,1H3

HIDE SMILES / InChI

Molecular Formula C12H15NO
Molecular Weight 189.2536
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:07:45 GMT 2025
Edited
by admin
on Mon Mar 31 22:07:45 GMT 2025
Record UNII
133FGY55V5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MPTP N-OXIDE
Common Name English
1-METHYL-4-PHENYLPYRIDINE N-OXIDE
Preferred Name English
PYRIDINE, 1,2,3,6-TETRAHYDRO-1-METHYL-4-PHENYL-, 1-OXIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20914716
Created by admin on Mon Mar 31 22:07:45 GMT 2025 , Edited by admin on Mon Mar 31 22:07:45 GMT 2025
PRIMARY
PUBCHEM
146896
Created by admin on Mon Mar 31 22:07:45 GMT 2025 , Edited by admin on Mon Mar 31 22:07:45 GMT 2025
PRIMARY
CAS
95969-40-7
Created by admin on Mon Mar 31 22:07:45 GMT 2025 , Edited by admin on Mon Mar 31 22:07:45 GMT 2025
PRIMARY
FDA UNII
133FGY55V5
Created by admin on Mon Mar 31 22:07:45 GMT 2025 , Edited by admin on Mon Mar 31 22:07:45 GMT 2025
PRIMARY