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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13NO3
Molecular Weight 267.2793
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [3-(4-Cyanophenoxy)phenyl]methyl acetate

SMILES

CC(=O)OCC1=CC(OC2=CC=C(C=C2)C#N)=CC=C1

InChI

InChIKey=PTPYPTHMNMQUMG-UHFFFAOYSA-N
InChI=1S/C16H13NO3/c1-12(18)19-11-14-3-2-4-16(9-14)20-15-7-5-13(10-17)6-8-15/h2-9H,11H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H13NO3
Molecular Weight 267.2793
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 19:46:44 GMT 2025
Edited
by admin
on Wed Apr 02 19:46:44 GMT 2025
Record UNII
X7JR7AD7VA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
[3-(4-Cyanophenoxy)phenyl]methyl acetate
Systematic Name English
Benzonitrile, 4-[3-[(acetyloxy)methyl]phenoxy]-
Preferred Name English
Code System Code Type Description
CAS
2990481-66-6
Created by admin on Wed Apr 02 19:46:44 GMT 2025 , Edited by admin on Wed Apr 02 19:46:44 GMT 2025
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PUBCHEM
162422096
Created by admin on Wed Apr 02 19:46:44 GMT 2025 , Edited by admin on Wed Apr 02 19:46:44 GMT 2025
PRIMARY
FDA UNII
X7JR7AD7VA
Created by admin on Wed Apr 02 19:46:44 GMT 2025 , Edited by admin on Wed Apr 02 19:46:44 GMT 2025
PRIMARY