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Details

Stereochemistry ACHIRAL
Molecular Formula C14H13N3O
Molecular Weight 239.2725
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-FORMYLVARENICLINE

SMILES

O=CN1C[C@@H]2C[C@H](C1)C3=CC4=C(C=C23)N=CC=N4

InChI

InChIKey=WFXWKRXICPYTSW-AOOOYVTPSA-N
InChI=1S/C14H13N3O/c18-8-17-6-9-3-10(7-17)12-5-14-13(4-11(9)12)15-1-2-16-14/h1-2,4-5,8-10H,3,6-7H2/t9-,10+

HIDE SMILES / InChI

Molecular Formula C14H13N3O
Molecular Weight 239.2725
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:35:50 GMT 2023
Edited
by admin
on Sat Dec 16 14:35:50 GMT 2023
Record UNII
DCP9JBZ34N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-FORMYLVARENICLINE
Common Name English
6,7,9,10-TETRAHYDRO-6,10-METHANO-8H-PYRAZINO(2,3-H)(3)BENZAZEPINE-8-CARBOXALDEHYDE
Systematic Name English
VARENICLINE METABOLITE M5
Common Name English
CP-697,535
Common Name English
6,10-METHANO-8H-PYRAZINO(2,3-H)(3)BENZAZEPINE-8-CARBOXALDEHYDE, 6,7,9,10-TETRAHYDRO-
Systematic Name English
Code System Code Type Description
PUBCHEM
29980534
Created by admin on Sat Dec 16 14:35:50 GMT 2023 , Edited by admin on Sat Dec 16 14:35:50 GMT 2023
PRIMARY
CAS
796865-82-2
Created by admin on Sat Dec 16 14:35:50 GMT 2023 , Edited by admin on Sat Dec 16 14:35:50 GMT 2023
PRIMARY
FDA UNII
DCP9JBZ34N
Created by admin on Sat Dec 16 14:35:50 GMT 2023 , Edited by admin on Sat Dec 16 14:35:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID30437901
Created by admin on Sat Dec 16 14:35:50 GMT 2023 , Edited by admin on Sat Dec 16 14:35:50 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE