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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21NO
Molecular Weight 291.3868
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOBENZAPRINE EPOXIDE

SMILES

CN(C)CCC=C1C2=C(C=CC=C2)C3OC3C4=C1C=CC=C4

InChI

InChIKey=ZNQICSISFHQSST-UHFFFAOYSA-N
InChI=1S/C20H21NO/c1-21(2)13-7-12-14-15-8-3-5-10-17(15)19-20(22-19)18-11-6-4-9-16(14)18/h3-6,8-12,19-20H,7,13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C20H21NO
Molecular Weight 291.3868
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:38:56 UTC 2023
Edited
by admin
on Thu Jul 06 23:38:56 UTC 2023
Record UNII
EM4S3SJ2YA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOBENZAPRINE EPOXIDE
Common Name English
CYCLOBENZAPRINE-10,11-EPOXIDE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80973809
Created by admin on Thu Jul 06 23:38:56 UTC 2023 , Edited by admin on Thu Jul 06 23:38:56 UTC 2023
PRIMARY
PUBCHEM
62938
Created by admin on Thu Jul 06 23:38:56 UTC 2023 , Edited by admin on Thu Jul 06 23:38:56 UTC 2023
PRIMARY
FDA UNII
EM4S3SJ2YA
Created by admin on Thu Jul 06 23:38:56 UTC 2023 , Edited by admin on Thu Jul 06 23:38:56 UTC 2023
PRIMARY
CAS
58256-08-9
Created by admin on Thu Jul 06 23:38:56 UTC 2023 , Edited by admin on Thu Jul 06 23:38:56 UTC 2023
PRIMARY
Related Record Type Details
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