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Details

Stereochemistry ACHIRAL
Molecular Formula C7H14N2O3
Molecular Weight 174.1977
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(Nitrosopropylamino)butanoic acid

SMILES

CCCN(CCCC(O)=O)N=O

InChI

InChIKey=YWDAVUKHNHOYAX-UHFFFAOYSA-N
InChI=1S/C7H14N2O3/c1-2-5-9(8-12)6-3-4-7(10)11/h2-6H2,1H3,(H,10,11)

HIDE SMILES / InChI

Approval Year

Name Type Language
Propyl-N-(3-carboxypropyl)nitrosamine, N-
Preferred Name English
4-(Nitrosopropylamino)butanoic acid
Systematic Name English
Butanoic acid, 4-(nitrosopropylamino)-
Systematic Name English
Code System Code Type Description
FDA UNII
3MPK9M9XQP
Created by admin on Mon Mar 31 19:34:08 GMT 2025 , Edited by admin on Mon Mar 31 19:34:08 GMT 2025
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CAS
56316-37-1
Created by admin on Mon Mar 31 19:34:08 GMT 2025 , Edited by admin on Mon Mar 31 19:34:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID90204858
Created by admin on Mon Mar 31 19:34:08 GMT 2025 , Edited by admin on Mon Mar 31 19:34:08 GMT 2025
PRIMARY
PUBCHEM
41843
Created by admin on Mon Mar 31 19:34:08 GMT 2025 , Edited by admin on Mon Mar 31 19:34:08 GMT 2025
PRIMARY