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Details

Stereochemistry ACHIRAL
Molecular Formula C9H17NO4
Molecular Weight 203.2356
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl N-(3-methoxy-3-oxopropyl)-N-methyl-beta-alaninate

SMILES

COC(=O)CCN(C)CCC(=O)OC

InChI

InChIKey=TYINRDVTTNNFKL-UHFFFAOYSA-N
InChI=1S/C9H17NO4/c1-10(6-4-8(11)13-2)7-5-9(12)14-3/h4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H17NO4
Molecular Weight 203.2356
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 Wed Apr 02 18:44:48 GMT 2025
Edited
by admin
on Wed Apr 02 18:44:48 GMT 2025
Record UNII
4SZH4W866W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-[(2-Methoxycarbonyl-ethyl)-methyl-amino]-propionic acid methyl ester
Preferred Name English
Methyl N-(3-methoxy-3-oxopropyl)-N-methyl-beta-alaninate
Systematic Name English
N-(3-Methoxy-3-oxopropyl)-N-methyl-?-alanine methyl ester
Systematic Name English
Propionic acid, 3,3?-(methylimino)di-, dimethyl ester
Systematic Name English
?-Alanine, N-(3-methoxy-3-oxopropyl)-N-methyl-, methyl ester
Systematic Name English
Dimethyl 3,3?-(methylazanediyl)dipropanoate
Systematic Name English
methyl 3-[(3-methoxy-3-oxopropyl)(methyl)amino]propanoate
Systematic Name English
Code System Code Type Description
FDA UNII
4SZH4W866W
Created by admin on Wed Apr 02 18:44:48 GMT 2025 , Edited by admin on Wed Apr 02 18:44:48 GMT 2025
PRIMARY
CAS
105-71-5
Created by admin on Wed Apr 02 18:44:48 GMT 2025 , Edited by admin on Wed Apr 02 18:44:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID801019004
Created by admin on Wed Apr 02 18:44:48 GMT 2025 , Edited by admin on Wed Apr 02 18:44:48 GMT 2025
PRIMARY
PUBCHEM
66925
Created by admin on Wed Apr 02 18:44:48 GMT 2025 , Edited by admin on Wed Apr 02 18:44:48 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT