| SpectraBase Spectrum ID |
JTR6DdqxQKI |
| Name |
7-((4-Fluorophenyl)amino)-9-(ethoxycarbonyl)-6-hydroxy-2H-pyrano[2,3-f]isoquinoline |
| Alternate Name(s) |
ethyl 7-(4-fluoroanilino)-6-hydroxy-2H-pyrano[2,3-f]isoquinoline-9-carboxylate |
| CAS Registry Number |
129708-12-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H17FN2O4 |
| InChI |
InChI=1S/C21H17FN2O4/c1-2-27-21(26)16-11-15-18(17(25)10-12-4-3-9-28-19(12)15)20(24-16)23-14-7-5-13(22)6-8-14/h3-8,10-11,25H,2,9H2,1H3,(H,23,24) |
| InChIKey |
CMXRQAVRNXCZFI-UHFFFAOYSA-N |
| Molecular Weight |
380.375 g/mol |
| SMILES |
Oc1cc2C=CCOc2c2c1c(nc(c2)C(=O)OCC)Nc1ccc(cc1)F |
| SPLASH |
splash10-053r-0009000000-86e4d4f393607eebe897 |
| Source of Spectrum |
J-55-6145-7 |
| Wiley ID |
1359709 |
![7-((4-Fluorophenyl)amino)-9-(ethoxycarbonyl)-6-hydroxy-2H-pyrano[2,3-f]isoquinoline](/api/spectrum/JTR6DdqxQKI/structure.png?h=300&w=458 "7-((4-Fluorophenyl)amino)-9-(ethoxycarbonyl)-6-hydroxy-2H-pyrano[2,3-f]isoquinoline")
