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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H14N2O
Molecular Weight 178.231
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NICOTINE N-OXIDE

SMILES

CN1CCC[C@H]1C2=C[N+]([O-])=CC=C2

InChI

InChIKey=YHXKVHQFWVYXIC-JTQLQIEISA-N
InChI=1S/C10H14N2O/c1-11-6-3-5-10(11)9-4-2-7-12(13)8-9/h2,4,7-8,10H,3,5-6H2,1H3/t10-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
NICOTINE N-OXIDE
Common Name English
PYRIDINE, 3-(1-METHYL-2-PYRROLIDINYL)-, 1-OXIDE, (S)-
Systematic Name English
NICOTINE 1-N-OXIDE
Common Name English
NICOTINE, 1-OXIDE
Common Name English
Code System Code Type Description
CHEBI
30734
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY
CAS
2820-55-5
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY
FDA UNII
8WQ7L5T6TJ
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID501316677
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY
CHEBI
132572
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY
PUBCHEM
211457
Created by admin on Sat Dec 16 14:56:03 GMT 2023 , Edited by admin on Sat Dec 16 14:56:03 GMT 2023
PRIMARY