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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H22BrNO3.ClH
Molecular Weight 416.737
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 25B-NBOME HYDROCHLORIDE

SMILES

Cl.COC1=CC=CC=C1CNCCC2=CC(OC)=C(Br)C=C2OC

InChI

InChIKey=HUHVUTZPPOFALF-UHFFFAOYSA-N
InChI=1S/C18H22BrNO3.ClH/c1-21-16-7-5-4-6-14(16)12-20-9-8-13-10-18(23-3)15(19)11-17(13)22-2;/h4-7,10-11,20H,8-9,12H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C18H22BrNO3
Molecular Weight 380.276
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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 Sat Dec 16 10:48:11 UTC 2023
Edited
by admin
on Sat Dec 16 10:48:11 UTC 2023
Record UNII
R68N5PML4X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
25B-NBOME HYDROCHLORIDE
Common Name English
2,5-DIMETHOXY-4-BROMO-N-(2-METHOXYBENZYL)PHENETHYLAMINE HYDROCHLORIDE
Systematic Name English
BENZENEETHANAMINE, 4-BROMO-2,5-DIMETHOXY-N-((2-METHOXYPHENYL)METHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
4-BROMO-2,5-DIMETHOXY-N-(2-METHOXYBENZYL)PHENETHYLAMINE HYDROCHLORIDE
Systematic Name English
Classification Tree Code System Code
DEA NO. 7536
Created by admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
Code System Code Type Description
PUBCHEM
76965389
Created by admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
PRIMARY
CAS
1539266-15-3
Created by admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
PRIMARY
FDA UNII
R68N5PML4X
Created by admin on Sat Dec 16 10:48:11 UTC 2023 , Edited by admin on Sat Dec 16 10:48:11 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY