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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H25NO3.ClH
Molecular Weight 351.868
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 25D-NBOME HYDROCHLORIDE

SMILES

Cl.COC1=CC(CCNCC2=C(OC)C=CC=C2)=C(OC)C=C1C

InChI

InChIKey=KJRUHRVUUSGHFU-UHFFFAOYSA-N
InChI=1S/C19H25NO3.ClH/c1-14-11-19(23-4)15(12-18(14)22-3)9-10-20-13-16-7-5-6-8-17(16)21-2;/h5-8,11-12,20H,9-10,13H2,1-4H3;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 C19H25NO3
Molecular Weight 315.4067
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 15:20:54 UTC 2023
Edited
by admin
on Sat Dec 16 15:20:54 UTC 2023
Record UNII
SZ5EGG4C4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
25D-NBOME HYDROCHLORIDE
Common Name English
BENZENEETHANAMINE, 2,5-DIMETHOXY-N-((2-METHOXYPHENYL)METHYL)-4-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
1539266-35-7
Created by admin on Sat Dec 16 15:20:54 UTC 2023 , Edited by admin on Sat Dec 16 15:20:54 UTC 2023
PRIMARY
PUBCHEM
121230756
Created by admin on Sat Dec 16 15:20:54 UTC 2023 , Edited by admin on Sat Dec 16 15:20:54 UTC 2023
PRIMARY
FDA UNII
SZ5EGG4C4Q
Created by admin on Sat Dec 16 15:20:54 UTC 2023 , Edited by admin on Sat Dec 16 15:20:54 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY