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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21NO2
Molecular Weight 247.3327
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYLPHENIDATE, THREO-(-)-

SMILES

CCOC(=O)[C@H]([C@@H]1CCCCN1)C2=CC=CC=C2

InChI

InChIKey=AIVSIRYZIBXTMM-KBPBESRZSA-N
InChI=1S/C15H21NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-5,8-9,13-14,16H,2,6-7,10-11H2,1H3/t13-,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H21NO2
Molecular Weight 247.3327
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 09:13:09 GMT 2025
Edited
by admin
on Wed Apr 02 09:13:09 GMT 2025
Record UNII
EVY4AD9Q52
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-ETHYLPHENIDATE
Preferred Name English
ETHYLPHENIDATE, THREO-(-)-
Common Name English
2-PIPERIDINEACETIC ACID, .ALPHA.-PHENYL-, ETHYL ESTER, (.ALPHA.S,2S)-
Systematic Name English
ETHYL (.ALPHA.S,2S)-.ALPHA.-PHENYL-2-PIPERIDINEACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
EVY4AD9Q52
Created by admin on Wed Apr 02 09:13:09 GMT 2025 , Edited by admin on Wed Apr 02 09:13:09 GMT 2025
PRIMARY
PUBCHEM
11358066
Created by admin on Wed Apr 02 09:13:09 GMT 2025 , Edited by admin on Wed Apr 02 09:13:09 GMT 2025
PRIMARY
CAS
852020-43-0
Created by admin on Wed Apr 02 09:13:09 GMT 2025 , Edited by admin on Wed Apr 02 09:13:09 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE