| SpectraBase Spectrum ID |
JUMQKdmKnck |
| Name |
2-Amino-4-[5-(2,4-dichlorophenyl)-2-furyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.038147716 u |
| Formula |
C20H14Cl2N2O3 |
| InChI |
InChI=1S/C20H14Cl2N2O3/c21-10-4-5-11(13(22)8-10)15-6-7-17(26-15)18-12(9-23)20(24)27-16-3-1-2-14(25)19(16)18/h4-8,18H,1-3,24H2 |
| InChIKey |
UQDVXOAVKIPHBK-UHFFFAOYSA-N |
| Molecular Weight |
401.249 g/mol |
| SMILES |
NC1=C(C(C=2C(=O)CCCC2O1)C=1OC(C2=C(C=C(C=C2)Cl)Cl)=CC1)C#N |
![2-amino-4-[5-(2,4-dichlorophenyl)-2-furyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile](/api/spectrum/JUMQKdmKnck/structure.png?h=300&w=458 "2-amino-4-[5-(2,4-dichlorophenyl)-2-furyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile")
