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Details

Stereochemistry ACHIRAL
Molecular Formula C16H12BrNO3
Molecular Weight 346.175
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Bromo-5-(4-cyanophenoxy)benzyl acetate

SMILES

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

InChI

InChIKey=LESJMARECHWSBI-UHFFFAOYSA-N
InChI=1S/C16H12BrNO3/c1-11(19)20-10-13-8-15(6-7-16(13)17)21-14-4-2-12(9-18)3-5-14/h2-8H,10H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-Bromo-5-(4-cyanophenoxy)benzyl acetate
Systematic Name English
4-[3-[(Acetyloxy)methyl]-4-bromophenoxy]benzonitrile
Systematic Name English
Benzonitrile, 4-[3-[(acetyloxy)methyl]-4-bromophenoxy]-
Systematic Name English
Code System Code Type Description
FDA UNII
9P8W35947U
Created by admin on Sat Dec 16 19:16:45 GMT 2023 , Edited by admin on Sat Dec 16 19:16:45 GMT 2023
PRIMARY
PUBCHEM
135385562
Created by admin on Sat Dec 16 19:16:45 GMT 2023 , Edited by admin on Sat Dec 16 19:16:45 GMT 2023
PRIMARY
CAS
2227126-09-0
Created by admin on Sat Dec 16 19:16:45 GMT 2023 , Edited by admin on Sat Dec 16 19:16:45 GMT 2023
PRIMARY
NIH
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