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

Details

Stereochemistry ACHIRAL
Molecular Formula C29H37BrFNO3
Molecular Weight 546.511
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMPERIDOL OCTANOATE

SMILES

CCCCCCCC(=O)OC1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)C3=CC=C(Br)C=C3

InChI

InChIKey=FJKCMWJOLKRJNX-UHFFFAOYSA-N
InChI=1S/C29H37BrFNO3/c1-2-3-4-5-6-9-28(34)35-29(24-12-14-25(30)15-13-24)18-21-32(22-19-29)20-7-8-27(33)23-10-16-26(31)17-11-23/h10-17H,2-9,18-22H2,1H3

HIDE SMILES / InChI

Molecular Formula C29H37BrFNO3
Molecular Weight 546.511
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 08:37:04 GMT 2023
Edited
by admin
on Sat Dec 16 08:37:04 GMT 2023
Record UNII
E2D29764DY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMPERIDOL OCTANOATE
Common Name English
BROMPERIDOL DECANOATE IMPURITY H [EP IMPURITY]
Common Name English
4-(4-BROMOPHENYL)-1-(4-(4-FLUOROPHENYL)-4-OXOBUTYL)PIPERIDIN-4-YL OCTANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
E2D29764DY
Created by admin on Sat Dec 16 08:37:04 GMT 2023 , Edited by admin on Sat Dec 16 08:37:04 GMT 2023
PRIMARY
PUBCHEM
76970846
Created by admin on Sat Dec 16 08:37:04 GMT 2023 , Edited by admin on Sat Dec 16 08:37:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP