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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H22F2N2
Molecular Weight 340.4096
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-Fluoro-2-[4-(4-fluorophenyl)butyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole

SMILES

FC1=CC=C(CCCCN2CCC3=C(C2)C4=C(N3)C=CC(F)=C4)C=C1

InChI

InChIKey=BLLBKUVGQDUZLE-UHFFFAOYSA-N
InChI=1S/C21H22F2N2/c22-16-6-4-15(5-7-16)3-1-2-11-25-12-10-21-19(14-25)18-13-17(23)8-9-20(18)24-21/h4-9,13,24H,1-3,10-12,14H2

HIDE SMILES / InChI

Molecular Formula C21H22F2N2
Molecular Weight 340.4096
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 Sat Dec 16 11:22:07 GMT 2023
Edited
by admin
on Sat Dec 16 11:22:07 GMT 2023
Record UNII
Q2D8UZV8U3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-Fluoro-2-[4-(4-fluorophenyl)butyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole
Systematic Name English
1H-Pyrido[4,3-b]indole, 8-fluoro-2-[4-(4-fluorophenyl)butyl]-2,3,4,5-tetrahydro-
Systematic Name English
8-Fluoro-2-(4-p-fluorophenylbutyl)-1,2,3,4-tetrahydro-γ-carboline
Systematic Name English
Code System Code Type Description
FDA UNII
Q2D8UZV8U3
Created by admin on Sat Dec 16 11:22:07 GMT 2023 , Edited by admin on Sat Dec 16 11:22:07 GMT 2023
PRIMARY
CAS
50807-79-9
Created by admin on Sat Dec 16 11:22:07 GMT 2023 , Edited by admin on Sat Dec 16 11:22:07 GMT 2023
PRIMARY
PUBCHEM
124781824
Created by admin on Sat Dec 16 11:22:07 GMT 2023 , Edited by admin on Sat Dec 16 11:22:07 GMT 2023
PRIMARY