SpectraBase Spectrum ID |
G3OPiN3pCZJ |
Name |
6-Allyl-1-(4-fluorophenylamino)-3-(ethoxycarbonyl)-5,8-isoquinolinequinone |
CAS Registry Number |
129708-19-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H17FN2O4 |
InChI |
InChI=1S/C21H17FN2O4/c1-3-5-12-10-17(25)18-15(19(12)26)11-16(21(27)28-4-2)24-20(18)23-14-8-6-13(22)7-9-14/h3,6-11H,1,4-5H2,2H3,(H,23,24) |
InChIKey |
WWDOITYEECROSN-UHFFFAOYSA-N |
Molecular Weight |
380.375 g/mol |
SMILES |
N(c1c2c(C(=O)C(=CC2=O)CC=C)cc(n1)C(=O)OCC)c1ccc(cc1)F |
SPLASH |
splash10-0udj-4009000000-2ef84bc32e94607a9903 |
Source of Spectrum |
J-55-6145-6 |
Wiley ID |
1359708 |