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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H22N2O3
Molecular Weight 326.3896
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 25CN-NBOME

SMILES

COC1=CC(CCNCC2=C(OC)C=CC=C2)=C(OC)C=C1C#N

InChI

InChIKey=QBJWOIWLBRLGKZ-UHFFFAOYSA-N
InChI=1S/C19H22N2O3/c1-22-17-7-5-4-6-15(17)13-21-9-8-14-10-19(24-3)16(12-20)11-18(14)23-2/h4-7,10-11,21H,8-9,13H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C19H22N2O3
Molecular Weight 326.3896
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 17:34:09 UTC 2023
Edited
by admin
on Sat Dec 16 17:34:09 UTC 2023
Record UNII
2B3AN5ZD3X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
25CN-NBOME
Common Name English
Benzonitrile, 2,5-dimethoxy-4-[2-[[(2-methoxyphenyl)methyl]amino]ethyl]-
Systematic Name English
2,5-DIMETHOXY-4-(2-(((2-METHOXYPHENYL)METHYL)AMINO)ETHYL)BENZONITRILE
Systematic Name English
Code System Code Type Description
CAS
1354632-16-8
Created by admin on Sat Dec 16 17:34:09 UTC 2023 , Edited by admin on Sat Dec 16 17:34:09 UTC 2023
PRIMARY
WIKIPEDIA
25CN-NBOMe
Created by admin on Sat Dec 16 17:34:09 UTC 2023 , Edited by admin on Sat Dec 16 17:34:09 UTC 2023
PRIMARY
FDA UNII
2B3AN5ZD3X
Created by admin on Sat Dec 16 17:34:09 UTC 2023 , Edited by admin on Sat Dec 16 17:34:09 UTC 2023
PRIMARY
EPA CompTox
DTXSID001045768
Created by admin on Sat Dec 16 17:34:09 UTC 2023 , Edited by admin on Sat Dec 16 17:34:09 UTC 2023
PRIMARY
PUBCHEM
152743520
Created by admin on Sat Dec 16 17:34:09 UTC 2023 , Edited by admin on Sat Dec 16 17:34:09 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
PARENT -> DERIVATIVE