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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16INO2.ClH
Molecular Weight 357.616
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOI hydrochloride, (R)-

SMILES

Cl.COC1=CC(C[C@@H](C)N)=C(OC)C=C1I

InChI

InChIKey=QVFDMWGKHUFODK-OGFXRTJISA-N
InChI=1S/C11H16INO2.ClH/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2;/h5-7H,4,13H2,1-3H3;1H/t7-;/m1./s1

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 C11H16INO2
Molecular Weight 321.1547
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:20:20 GMT 2023
Edited
by admin
on Sat Dec 16 19:20:20 GMT 2023
Record UNII
V9XP56T9PS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOI hydrochloride, (R)-
Common Name English
Benzeneethanamine, 4-iodo-2,5-dimethoxy-α-methyl-, hydrochloride, (αR)-
Systematic Name English
Benzeneethanamine, 4-iodo-2,5-dimethoxy-α-methyl-, hydrochloride (1:1), (αR)-
Systematic Name English
2,5-Dimethoxy-4-iodoamphetamine hydrochloride, (R)-
Common Name English
(-)-DOI-HCl
Common Name English
Benzeneethanamine, 4-iodo-2,5-dimethoxy-α-methyl-, hydrochloride, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
11957541
Created by admin on Sat Dec 16 19:20:20 GMT 2023 , Edited by admin on Sat Dec 16 19:20:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID40474685
Created by admin on Sat Dec 16 19:20:20 GMT 2023 , Edited by admin on Sat Dec 16 19:20:20 GMT 2023
PRIMARY
FDA UNII
V9XP56T9PS
Created by admin on Sat Dec 16 19:20:20 GMT 2023 , Edited by admin on Sat Dec 16 19:20:20 GMT 2023
PRIMARY
CAS
82864-02-6
Created by admin on Sat Dec 16 19:20:20 GMT 2023 , Edited by admin on Sat Dec 16 19:20:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE