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

Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16ClNO2
Molecular Weight 229.703
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DOC, (R)-

SMILES

COC1=CC(C[C@@H](C)N)=C(OC)C=C1Cl

InChI

InChIKey=ACRITBNCBMTINK-SSDOTTSWSA-N
InChI=1S/C11H16ClNO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3/t7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H16ClNO2
Molecular Weight 229.703
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 19:23:22 GMT 2023
Edited
by admin
on Sat Dec 16 19:23:22 GMT 2023
Record UNII
FP7JR76356
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DOC, (R)-
Common Name English
Benzeneethanamine, 4-chloro-2,5-dimethoxy-α-methyl-, (αR)-
Systematic Name English
(R)-2,5-Dimethoxy-4-chloroamphetamine
Common Name English
(αR)-4-Chloro-2,5-dimethoxy-α-methylbenzeneethanamine
Systematic Name English
2,5-Dimethoxy-4-chloroamphetamine, (R)-
Common Name English
Benzeneethanamine, 4-chloro-2,5-dimethoxy-α-methyl-, (R)-
Systematic Name English
Code System Code Type Description
FDA UNII
FP7JR76356
Created by admin on Sat Dec 16 19:23:23 GMT 2023 , Edited by admin on Sat Dec 16 19:23:23 GMT 2023
PRIMARY
CAS
773790-50-4
Created by admin on Sat Dec 16 19:23:23 GMT 2023 , Edited by admin on Sat Dec 16 19:23:23 GMT 2023
PRIMARY
PUBCHEM
57461568
Created by admin on Sat Dec 16 19:23:23 GMT 2023 , Edited by admin on Sat Dec 16 19:23:23 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER
SALT/SOLVATE -> PARENT