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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H10N2O2
Molecular Weight 226.2307
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(Imidazol-1-ylmethyl)chromen-2-one

SMILES

O=C1OC2=CC=C(CN3C=CN=C3)C=C2C=C1

InChI

InChIKey=IYELJSUQTAUCCY-UHFFFAOYSA-N
InChI=1S/C13H10N2O2/c16-13-4-2-11-7-10(1-3-12(11)17-13)8-15-6-5-14-9-15/h1-7,9H,8H2

HIDE SMILES / InChI

Molecular Formula C13H10N2O2
Molecular Weight 226.2307
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 15:30:11 GMT 2023
Edited
by admin
on Sat Dec 16 15:30:11 GMT 2023
Record UNII
4948AJR2JU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-(Imidazol-1-ylmethyl)chromen-2-one
Systematic Name English
2H-1-Benzopyran-2-one, 6-(1H-imidazol-1-ylmethyl)-
Systematic Name English
6-(1H-Imidazol-1-ylmethyl)-2H-1-benzopyran-2-one
Systematic Name English
Code System Code Type Description
CAS
828265-61-8
Created by admin on Sat Dec 16 15:30:11 GMT 2023 , Edited by admin on Sat Dec 16 15:30:11 GMT 2023
PRIMARY
PUBCHEM
11322098
Created by admin on Sat Dec 16 15:30:11 GMT 2023 , Edited by admin on Sat Dec 16 15:30:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID10462317
Created by admin on Sat Dec 16 15:30:11 GMT 2023 , Edited by admin on Sat Dec 16 15:30:11 GMT 2023
PRIMARY
FDA UNII
4948AJR2JU
Created by admin on Sat Dec 16 15:30:11 GMT 2023 , Edited by admin on Sat Dec 16 15:30:11 GMT 2023
PRIMARY