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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H11ClN2O2
Molecular Weight 226.66
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Chloro-1,3-dihydro-1-(3-hydroxypropyl)-2H-benzimidazol-2-one

SMILES

OCCCN1C(=O)NC2=CC(Cl)=CC=C12

InChI

InChIKey=KWZXVSVGUXKSJY-UHFFFAOYSA-N
InChI=1S/C10H11ClN2O2/c11-7-2-3-9-8(6-7)12-10(15)13(9)4-1-5-14/h2-3,6,14H,1,4-5H2,(H,12,15)

HIDE SMILES / InChI

Molecular Formula C10H11ClN2O2
Molecular Weight 226.66
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:56:43 GMT 2023
Edited
by admin
on Sat Dec 16 16:56:43 GMT 2023
Record UNII
9HLS4DMG4Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Chloro-1,3-dihydro-1-(3-hydroxypropyl)-2H-benzimidazol-2-one
Systematic Name English
2H-Benzimidazol-2-one, 5-chloro-1,3-dihydro-1-(3-hydroxypropyl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30978445
Created by admin on Sat Dec 16 16:56:43 GMT 2023 , Edited by admin on Sat Dec 16 16:56:43 GMT 2023
PRIMARY
FDA UNII
9HLS4DMG4Q
Created by admin on Sat Dec 16 16:56:43 GMT 2023 , Edited by admin on Sat Dec 16 16:56:43 GMT 2023
PRIMARY
CAS
62780-76-1
Created by admin on Sat Dec 16 16:56:43 GMT 2023 , Edited by admin on Sat Dec 16 16:56:43 GMT 2023
PRIMARY
PUBCHEM
3017358
Created by admin on Sat Dec 16 16:56:43 GMT 2023 , Edited by admin on Sat Dec 16 16:56:43 GMT 2023
PRIMARY