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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H12N2O2
Molecular Weight 228.2466
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(6-Methoxy-2H-1-benzopyran-3-yl)-1H-imidazole

SMILES

COC1=CC2=C(OCC(=C2)N3C=CN=C3)C=C1

InChI

InChIKey=IVPAQQLAILLFOT-UHFFFAOYSA-N
InChI=1S/C13H12N2O2/c1-16-12-2-3-13-10(7-12)6-11(8-17-13)15-5-4-14-9-15/h2-7,9H,8H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
1-(6-Methoxy-2H-1-benzopyran-3-yl)-1H-imidazole
Systematic Name English
1H-Imidazole, 1-(6-methoxy-2H-1-benzopyran-3-yl)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID701008969
Created by admin on Sat Dec 16 19:33:36 GMT 2023 , Edited by admin on Sat Dec 16 19:33:36 GMT 2023
PRIMARY
FDA UNII
F2MQR57H3G
Created by admin on Sat Dec 16 19:33:36 GMT 2023 , Edited by admin on Sat Dec 16 19:33:36 GMT 2023
PRIMARY
PUBCHEM
13284885
Created by admin on Sat Dec 16 19:33:36 GMT 2023 , Edited by admin on Sat Dec 16 19:33:36 GMT 2023
PRIMARY
CAS
89781-61-3
Created by admin on Sat Dec 16 19:33:36 GMT 2023 , Edited by admin on Sat Dec 16 19:33:36 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966