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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H11BrN2
Molecular Weight 251.122
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Bromo-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

SMILES

BrC1=CC2=C(C=C1)C3=C(CNCC3)N2

InChI

InChIKey=XAHAQVIJZAMMLO-UHFFFAOYSA-N
InChI=1S/C11H11BrN2/c12-7-1-2-8-9-3-4-13-6-11(9)14-10(8)5-7/h1-2,5,13-14H,3-4,6H2

HIDE SMILES / InChI

Molecular Formula C11H11BrN2
Molecular Weight 251.122
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 Wed Apr 02 06:03:28 GMT 2025
Edited
by admin
on Wed Apr 02 06:03:28 GMT 2025
Record UNII
JSB9R5M9UG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-Pyrido[3,4-b]indole, 7-bromo-2,3,4,9-tetrahydro-
Preferred Name English
7-Bromo-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Systematic Name English
7-bromo-1H,2H,3H,4H,9H-pyrido[3,4-b]indole
Systematic Name English
Code System Code Type Description
FDA UNII
JSB9R5M9UG
Created by admin on Wed Apr 02 06:03:28 GMT 2025 , Edited by admin on Wed Apr 02 06:03:28 GMT 2025
PRIMARY
CAS
108061-47-8
Created by admin on Wed Apr 02 06:03:28 GMT 2025 , Edited by admin on Wed Apr 02 06:03:28 GMT 2025
PRIMARY
EPA CompTox
DTXSID00434588
Created by admin on Wed Apr 02 06:03:28 GMT 2025 , Edited by admin on Wed Apr 02 06:03:28 GMT 2025
PRIMARY
PUBCHEM
10037784
Created by admin on Wed Apr 02 06:03:28 GMT 2025 , Edited by admin on Wed Apr 02 06:03:28 GMT 2025
PRIMARY