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Details

Stereochemistry UNKNOWN
Molecular Formula C12H17NO.ClH
Molecular Weight 227.73
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TREBENZOMINE HYDROCHLORIDE

SMILES

Cl.CC1OC2=C(CC1N(C)C)C=CC=C2

InChI

InChIKey=FUSALJQLPCXPMH-UHFFFAOYSA-N
InChI=1S/C12H17NO.ClH/c1-9-11(13(2)3)8-10-6-4-5-7-12(10)14-9;/h4-7,9,11H,8H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C12H17NO
Molecular Weight 191.2695
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:55:11 UTC 2023
Edited
by admin
on Fri Dec 15 18:55:11 UTC 2023
Record UNII
3W59Q537SA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TREBENZOMINE HYDROCHLORIDE
USAN  
USAN  
Official Name English
TREBENZOMINE HCL
Common Name English
TREBENZOMINE HYDROCHLORIDE [USAN]
Common Name English
CI-686.HCL
Code English
CI-686 HYDROCHLORIDE
Code English
Classification Tree Code System Code
NCI_THESAURUS C29710
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
Code System Code Type Description
MESH
C006122
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
PUBCHEM
3084410
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
FDA UNII
3W59Q537SA
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
CAS
23915-74-4
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID80946735
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
NCI_THESAURUS
C152718
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL2111184
Created by admin on Fri Dec 15 18:55:11 UTC 2023 , Edited by admin on Fri Dec 15 18:55:11 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY