U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H9ClO2
Molecular Weight 256.684
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-CHLOROBENZAL)PHTHALIDE, (E)-

SMILES

ClC1=CC=C(\C=C2\OC(=O)C3=CC=CC=C23)C=C1

InChI

InChIKey=OHRFHJYUEWVXBD-NTEUORMPSA-N
InChI=1S/C15H9ClO2/c16-11-7-5-10(6-8-11)9-14-12-3-1-2-4-13(12)15(17)18-14/h1-9H/b14-9+

HIDE SMILES / InChI

Molecular Formula C15H9ClO2
Molecular Weight 256.684
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 05:49:38 UTC 2023
Edited
by admin
on Sat Dec 16 05:49:38 UTC 2023
Record UNII
Z3TW2E6FVN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-CHLOROBENZAL)PHTHALIDE, (E)-
Systematic Name English
1(3H)-ISOBENZOFURANONE, 3-((4-CHLOROPHENYL)METHYLENE)-, (3E)-
Systematic Name English
AZELASTINE HYDROCHLORIDE IMPURITY E, (E)-
Common Name English
Code System Code Type Description
FDA UNII
Z3TW2E6FVN
Created by admin on Sat Dec 16 05:49:38 UTC 2023 , Edited by admin on Sat Dec 16 05:49:38 UTC 2023
PRIMARY
PUBCHEM
10467624
Created by admin on Sat Dec 16 05:49:38 UTC 2023 , Edited by admin on Sat Dec 16 05:49:38 UTC 2023
PRIMARY
CAS
94801-28-2
Created by admin on Sat Dec 16 05:49:38 UTC 2023 , Edited by admin on Sat Dec 16 05:49:38 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY