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Details

Stereochemistry UNKNOWN
Molecular Formula C26H30Cl2F3NO.ClH
Molecular Weight 536.885
Optical Activity ( - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HALOFANTRINE HYDROCHLORIDE, (-)-

SMILES

Cl.CCCCN(CCCC)CCC(O)C1=C2C=CC(=CC2=C3C=C(Cl)C=C(Cl)C3=C1)C(F)(F)F

InChI

InChIKey=WANGFTDWOFGECH-UHFFFAOYSA-N
InChI=1S/C26H30Cl2F3NO.ClH/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23;/h7-8,13-16,25,33H,3-6,9-12H2,1-2H3;1H

HIDE SMILES / InChI

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

Molecular Formula C26H30Cl2F3NO
Molecular Weight 500.424
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:26:26 UTC 2023
Edited
by admin
on Sat Dec 16 10:26:26 UTC 2023
Record UNII
2B7ENL644K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HALOFANTRINE HYDROCHLORIDE, (-)-
Common Name English
(-)-HALOFANTRINE HYDROCHLORIDE
Common Name English
9-PHENANTHRENEMETHANOL, 1,3-DICHLORO-.ALPHA.-(2-(DIBUTYLAMINO)ETHYL)-6-(TRIFLUOROMETHYL)-, HYDROCHLORIDE, (-)-
Systematic Name English
Code System Code Type Description
CAS
66051-64-7
Created by admin on Sat Dec 16 10:26:26 UTC 2023 , Edited by admin on Sat Dec 16 10:26:26 UTC 2023
PRIMARY
FDA UNII
2B7ENL644K
Created by admin on Sat Dec 16 10:26:26 UTC 2023 , Edited by admin on Sat Dec 16 10:26:26 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER