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

Details

Stereochemistry RACEMIC
Molecular Formula C13H13NO5
Molecular Weight 263.246
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of 5-(3,4-CARBONYLDIOXYPHENYL)-3-ISOPROPYL-2-OXAZOLIDINONE

SMILES

CC(C)N1CC(OC1=O)C2=CC=C3OC(=O)OC3=C2

InChI

InChIKey=TYZQRRNMKWCMMA-UHFFFAOYSA-N
InChI=1S/C13H13NO5/c1-7(2)14-6-11(17-12(14)15)8-3-4-9-10(5-8)19-13(16)18-9/h3-5,7,11H,6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H13NO5
Molecular Weight 263.246
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:57:16 GMT 2025
Edited
by admin
on Mon Mar 31 17:57:16 GMT 2025
Record UNII
CEJ40QV5EH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(3,4-CARBONYLDIOXYPHENYL)-3-ISOPROPYL-2-OXAZOLIDINONE
Systematic Name English
2-OXAZOLIDINONE, 3-(1-METHYLETHYL)-5-(2-OXO-1,3-BENZODIOXOL-5-YL)-
Preferred Name English
Code System Code Type Description
CAS
23271-77-4
Created by admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
PRIMARY
PUBCHEM
31797
Created by admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
PRIMARY
FDA UNII
CEJ40QV5EH
Created by admin on Mon Mar 31 17:57:16 GMT 2025 , Edited by admin on Mon Mar 31 17:57:16 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY