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Details

Stereochemistry ACHIRAL
Molecular Formula C25H39NO5
Molecular Weight 433.5809
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-acetamido-2-[(acetyloxy)methyl]-4-(4-octylphenyl)butyl acetate

SMILES

CCCCCCCCC1=CC=C(CCC(COC(C)=O)(COC(C)=O)NC(C)=O)C=C1

InChI

InChIKey=GNDIBYIKXCMJGO-UHFFFAOYSA-N
InChI=1S/C25H39NO5/c1-5-6-7-8-9-10-11-23-12-14-24(15-13-23)16-17-25(26-20(2)27,18-30-21(3)28)19-31-22(4)29/h12-15H,5-11,16-19H2,1-4H3,(H,26,27)

HIDE SMILES / InChI

Molecular Formula C25H39NO5
Molecular Weight 433.5809
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 11:14:20 GMT 2023
Edited
by admin
on Sat Dec 16 11:14:20 GMT 2023
Record UNII
9JYX2M778X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-acetamido-2-[(acetyloxy)methyl]-4-(4-octylphenyl)butyl acetate
Systematic Name English
FINGOLIMOD HYDROCHLORIDE IMPURITY H [EP IMPURITY]
Common Name English
Acetamide, N-[1,1-bis[(acetyloxy)methyl]-3-(4-octylphenyl)propyl]-
Systematic Name English
N-[1,1-Bis[(acetyloxy)methyl]-3-(4-octylphenyl)propyl]acetamide
Systematic Name English
Code System Code Type Description
CAS
162358-09-0
Created by admin on Sat Dec 16 11:14:20 GMT 2023 , Edited by admin on Sat Dec 16 11:14:20 GMT 2023
PRIMARY
FDA UNII
9JYX2M778X
Created by admin on Sat Dec 16 11:14:20 GMT 2023 , Edited by admin on Sat Dec 16 11:14:20 GMT 2023
PRIMARY
PUBCHEM
10646445
Created by admin on Sat Dec 16 11:14:20 GMT 2023 , Edited by admin on Sat Dec 16 11:14:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID50442936
Created by admin on Sat Dec 16 11:14:20 GMT 2023 , Edited by admin on Sat Dec 16 11:14:20 GMT 2023
PRIMARY
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