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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20N2O3
Molecular Weight 264.3202
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPIONANILIDE, 3'-HYDROXY-, TERT-BUTYLCARBAMATE (ESTER)

SMILES

CCC(=O)NC1=CC(OC(=O)NC(C)(C)C)=CC=C1

InChI

InChIKey=INQDFAFCOWKYMG-UHFFFAOYSA-N
InChI=1S/C14H20N2O3/c1-5-12(17)15-10-7-6-8-11(9-10)19-13(18)16-14(2,3)4/h6-9H,5H2,1-4H3,(H,15,17)(H,16,18)

HIDE SMILES / InChI

Molecular Formula C14H20N2O3
Molecular Weight 264.3202
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 Tue Apr 01 19:59:39 GMT 2025
Edited
by admin
on Tue Apr 01 19:59:39 GMT 2025
Record UNII
XJM89N91M2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-222510
Preferred Name English
PROPIONANILIDE, 3'-HYDROXY-, TERT-BUTYLCARBAMATE (ESTER)
Common Name English
CARBAMIC ACID, (1,1-DIMETHYLETHYL)-, 3-((1-OXOPROPYL)AMINO)PHENYL ESTER
Systematic Name English
CARBAMIC ACID, TERT-BUTYL-, ESTER WITH 3'-HYDROXYPROPIONANILIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80170391
Created by admin on Tue Apr 01 19:59:39 GMT 2025 , Edited by admin on Tue Apr 01 19:59:39 GMT 2025
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PUBCHEM
99420
Created by admin on Tue Apr 01 19:59:39 GMT 2025 , Edited by admin on Tue Apr 01 19:59:39 GMT 2025
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FDA UNII
XJM89N91M2
Created by admin on Tue Apr 01 19:59:39 GMT 2025 , Edited by admin on Tue Apr 01 19:59:39 GMT 2025
PRIMARY
NSC
222510
Created by admin on Tue Apr 01 19:59:39 GMT 2025 , Edited by admin on Tue Apr 01 19:59:39 GMT 2025
PRIMARY
CAS
17788-26-0
Created by admin on Tue Apr 01 19:59:39 GMT 2025 , Edited by admin on Tue Apr 01 19:59:39 GMT 2025
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