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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H10ClNO
Molecular Weight 243.688
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-Chlorophenyl)-2,3-dihydro-1H-isoindol-1-one, (3S)-

SMILES

ClC1=CC=C(C=C1)[C@@H]2NC(=O)C3=CC=CC=C23

InChI

InChIKey=OMUHBVDRMKRVLW-ZDUSSCGKSA-N
InChI=1S/C14H10ClNO/c15-10-7-5-9(6-8-10)13-11-3-1-2-4-12(11)14(17)16-13/h1-8,13H,(H,16,17)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C14H10ClNO
Molecular Weight 243.688
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:50:53 GMT 2025
Edited
by admin
on Wed Apr 02 18:50:53 GMT 2025
Record UNII
HA8RSH78FT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-Chlorophenyl)-2,3-dihydro-1H-isoindol-1-one, (3S)-
Systematic Name English
(+)-3-(4-Chlorophenyl)-2,3-dihydro-1H-isoindol-1-one
Preferred Name English
1H-Isoindol-1-one, 3-(4-chlorophenyl)-2,3-dihydro-, (3S)-
Systematic Name English
(3S)-3-(4-Chlorophenyl)-2,3-dihydro-1H-isoindol-1-one
Systematic Name English
Code System Code Type Description
PUBCHEM
92140067
Created by admin on Wed Apr 02 18:50:53 GMT 2025 , Edited by admin on Wed Apr 02 18:50:53 GMT 2025
PRIMARY
FDA UNII
HA8RSH78FT
Created by admin on Wed Apr 02 18:50:53 GMT 2025 , Edited by admin on Wed Apr 02 18:50:53 GMT 2025
PRIMARY
CAS
1436871-14-5
Created by admin on Wed Apr 02 18:50:53 GMT 2025 , Edited by admin on Wed Apr 02 18:50:53 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
CAS
1329993-62-5
Created by admin on Wed Apr 02 18:50:53 GMT 2025 , Edited by admin on Wed Apr 02 18:50:53 GMT 2025
PRIMARY
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