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Details

Stereochemistry ACHIRAL
Molecular Formula C17H14O3
Molecular Weight 266.2913
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-HYDROXY-3,5-DIMETHYLBENZYLIDENE)-2-BENZOFURAN-1(3H)-ONE

SMILES

CC1=CC(C=C2OC(=O)C3=CC=CC=C23)=CC(C)=C1O

InChI

InChIKey=ANSOBNWAUKQYFV-DHDCSXOGSA-N
InChI=1S/C17H14O3/c1-10-7-12(8-11(2)16(10)18)9-15-13-5-3-4-6-14(13)17(19)20-15/h3-9,18H,1-2H3/b15-9-

HIDE SMILES / InChI

Molecular Formula C17H14O3
Molecular Weight 266.2913
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:47:47 GMT 2023
Edited
by admin
on Sat Dec 16 12:47:47 GMT 2023
Record UNII
2W3G7KCB72
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-HYDROXY-3,5-DIMETHYLBENZYLIDENE)-2-BENZOFURAN-1(3H)-ONE
Systematic Name English
3-(3,5-Dimethyl-4-hydroxybenzylidene)phthalide
Common Name English
NSC-281752
Code English
1(3H)-Isobenzofuranone, 3-[(4-hydroxy-3,5-dimethylphenyl)methylene]-
Systematic Name English
3-[(4-Hydroxy-3,5-dimethylphenyl)methylene]-1(3H)-isobenzofuranone
Systematic Name English
Code System Code Type Description
NSC
281752
Created by admin on Sat Dec 16 12:47:47 GMT 2023 , Edited by admin on Sat Dec 16 12:47:47 GMT 2023
PRIMARY
FDA UNII
2W3G7KCB72
Created by admin on Sat Dec 16 12:47:47 GMT 2023 , Edited by admin on Sat Dec 16 12:47:47 GMT 2023
PRIMARY
PUBCHEM
6184403
Created by admin on Sat Dec 16 12:47:47 GMT 2023 , Edited by admin on Sat Dec 16 12:47:47 GMT 2023
PRIMARY
CAS
69574-09-0
Created by admin on Sat Dec 16 12:47:47 GMT 2023 , Edited by admin on Sat Dec 16 12:47:47 GMT 2023
PRIMARY