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Details

Stereochemistry ACHIRAL
Molecular Formula C15H21NO4
Molecular Weight 279.3315
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Aspirin Trelamine

SMILES

CCN(CC)CCOC(=O)C1=CC=CC=C1OC(C)=O

InChI

InChIKey=GHIVDTCFLFLOBV-UHFFFAOYSA-N
InChI=1S/C15H21NO4/c1-4-16(5-2)10-11-19-15(18)13-8-6-7-9-14(13)20-12(3)17/h6-9H,4-5,10-11H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C15H21NO4
Molecular Weight 279.3315
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 Fri Dec 15 16:49:49 UTC 2023
Edited
by admin
on Fri Dec 15 16:49:49 UTC 2023
Record UNII
JKW59XM343
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Aspirin Trelamine
USAN  
Official Name English
2-(Diethylamino)ethyl 2-acetoxybenzoate
Systematic Name English
X-0023
Code English
EDAN
WHO-DD  
Common Name English
2-(ACETYLOXY)BENZOIC ACID 2-(DIETHYLAMINO)ETHYL ESTER
Systematic Name English
ASPIRIN TRELAMINE [USAN]
Common Name English
Benzoic acid, 2-(acetyloxy)-, 2-(diethylamino)ethyl ester
Systematic Name English
Edan [WHO-DD]
Common Name English
TF-0023
Code English
SALICYLIC ACID, 2-(DIETHYLAMINO)ETHYL ESTER, ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
JKW59XM343
Created by admin on Fri Dec 15 16:49:49 UTC 2023 , Edited by admin on Fri Dec 15 16:49:49 UTC 2023
PRIMARY
PUBCHEM
10245201
Created by admin on Fri Dec 15 16:49:49 UTC 2023 , Edited by admin on Fri Dec 15 16:49:49 UTC 2023
PRIMARY
EPA CompTox
DTXSID80222228
Created by admin on Fri Dec 15 16:49:49 UTC 2023 , Edited by admin on Fri Dec 15 16:49:49 UTC 2023
PRIMARY
CAS
7194-12-9
Created by admin on Fri Dec 15 16:49:49 UTC 2023 , Edited by admin on Fri Dec 15 16:49:49 UTC 2023
PRIMARY
USAN
LM-73
Created by admin on Fri Dec 15 16:49:49 UTC 2023 , Edited by admin on Fri Dec 15 16:49:49 UTC 2023
PRIMARY
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SALT/SOLVATE -> PARENT
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ACTIVE MOIETY