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Details

Stereochemistry ACHIRAL
Molecular Formula C20H21NO
Molecular Weight 291.3868
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-HYDROXYCYCLOBENZAPRINE

SMILES

CN(C)CC\C=C1\C2=C(C=CC=C2)C=CC3=C1C=C(O)C=C3

InChI

InChIKey=UHLPYBQGKLHIFK-UWVJOHFNSA-N
InChI=1S/C20H21NO/c1-21(2)13-5-8-19-18-7-4-3-6-15(18)9-10-16-11-12-17(22)14-20(16)19/h3-4,6-12,14,22H,5,13H2,1-2H3/b19-8-

HIDE SMILES / InChI

Molecular Formula C20H21NO
Molecular Weight 291.3868
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 13:44:17 UTC 2023
Edited
by admin
on Thu Jul 06 13:44:17 UTC 2023
Record UNII
P3X3656JH9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-HYDROXYCYCLOBENZAPRINE
Common Name English
Code System Code Type Description
PUBCHEM
29981386
Created by admin on Thu Jul 06 13:44:17 UTC 2023 , Edited by admin on Thu Jul 06 13:44:17 UTC 2023
PRIMARY
FDA UNII
P3X3656JH9
Created by admin on Thu Jul 06 13:44:17 UTC 2023 , Edited by admin on Thu Jul 06 13:44:17 UTC 2023
PRIMARY
CAS
30235-48-4
Created by admin on Thu Jul 06 13:44:17 UTC 2023 , Edited by admin on Thu Jul 06 13:44:17 UTC 2023
PRIMARY
EPA CompTox
DTXSID101170075
Created by admin on Thu Jul 06 13:44:17 UTC 2023 , Edited by admin on Thu Jul 06 13:44:17 UTC 2023
PRIMARY
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