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

Details

Stereochemistry RACEMIC
Molecular Formula C10H13N3O
Molecular Weight 191.2297
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-NITROSOANABASINE, (RS)-

SMILES

O=NN1CCCCC1C2=CC=CN=C2

InChI

InChIKey=BXYPVKMROLGXJI-UHFFFAOYSA-N
InChI=1S/C10H13N3O/c14-12-13-7-2-1-5-10(13)9-4-3-6-11-8-9/h3-4,6,8,10H,1-2,5,7H2

HIDE SMILES / InChI

Molecular Formula C10H13N3O
Molecular Weight 191.2297
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 Sat Dec 16 11:36:13 UTC 2023
Edited
by admin
on Sat Dec 16 11:36:13 UTC 2023
Record UNII
Y7VU5E9XAT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-NITROSOANABASINE, (RS)-
Common Name English
PIPERIDINE, 1-NITROSO-2-(3-PYRIDYL)-
Systematic Name English
N-NITROSOANABASINE, (±)-
Common Name English
3-(1-NITROSO-2-PIPERIDINYL)PYRIDINE
Systematic Name English
Code System Code Type Description
FDA UNII
Y7VU5E9XAT
Created by admin on Sat Dec 16 11:36:13 UTC 2023 , Edited by admin on Sat Dec 16 11:36:13 UTC 2023
PRIMARY
CAS
37620-20-5
Created by admin on Sat Dec 16 11:36:13 UTC 2023 , Edited by admin on Sat Dec 16 11:36:13 UTC 2023
PRIMARY
EPA CompTox
DTXSID3021019
Created by admin on Sat Dec 16 11:36:13 UTC 2023 , Edited by admin on Sat Dec 16 11:36:13 UTC 2023
PRIMARY
PUBCHEM
14335
Created by admin on Sat Dec 16 11:36:13 UTC 2023 , Edited by admin on Sat Dec 16 11:36:13 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE