U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C16H16O3
Molecular Weight 256.2964
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLPROPYL SALICYLATE

SMILES

OC1=CC=CC=C1C(=O)OCCCC2=CC=CC=C2

InChI

InChIKey=GMHNYYKDPGWAJR-UHFFFAOYSA-N
InChI=1S/C16H16O3/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,17H,6,9,12H2

HIDE SMILES / InChI

Molecular Formula C16H16O3
Molecular Weight 256.2964
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
3BE83JUF0V
Record Status Validated (UNII)
Record Version