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Details

Stereochemistry ACHIRAL
Molecular Formula C13H19NO2
Molecular Weight 221.2955
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Diethylaminoethyl benzoate

SMILES

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

InChI

InChIKey=GEVPHAFTDXTZHY-UHFFFAOYSA-N
InChI=1S/C13H19NO2/c1-3-14(4-2)10-11-16-13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H19NO2
Molecular Weight 221.2955
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 Sat Dec 16 19:31:25 GMT 2023
Edited
by admin
on Sat Dec 16 19:31:25 GMT 2023
Record UNII
XQV4S4W9G3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Diethylaminoethyl benzoate
Systematic Name English
Benzoic acid, 2-(diethylamino)ethyl ester
Systematic Name English
β-Benzoyloxyethyl diethylamine
Systematic Name English
AI3-05644
Code English
Ethanol, 2-diethylamino-, benzoate
Systematic Name English
Code System Code Type Description
PUBCHEM
17390
Created by admin on Sat Dec 16 19:31:25 GMT 2023 , Edited by admin on Sat Dec 16 19:31:25 GMT 2023
PRIMARY
CAS
2572-39-6
Created by admin on Sat Dec 16 19:31:25 GMT 2023 , Edited by admin on Sat Dec 16 19:31:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID10180408
Created by admin on Sat Dec 16 19:31:25 GMT 2023 , Edited by admin on Sat Dec 16 19:31:25 GMT 2023
PRIMARY
FDA UNII
XQV4S4W9G3
Created by admin on Sat Dec 16 19:31:25 GMT 2023 , Edited by admin on Sat Dec 16 19:31:25 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT