| SpectraBase Spectrum ID |
Hkde5RJW80j |
| Name |
5-(Allyloxy)-3-(ethoxycarbonyl)-6-methoxy-1-(phenyl-amino)isoquinoline |
| Alternate Name(s) |
ethyl 5-(allyloxy)-1-anilino-6-methoxy-3-isoquinolinecarboxylate |
| CAS Registry Number |
129708-10-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22N2O4 |
| InChI |
InChI=1S/C22H22N2O4/c1-4-13-28-20-17-14-18(22(25)27-5-2)24-21(16(17)11-12-19(20)26-3)23-15-9-7-6-8-10-15/h4,6-12,14H,1,5,13H2,2-3H3,(H,23,24) |
| InChIKey |
ZAIVWRQMIDZNJR-UHFFFAOYSA-N |
| Molecular Weight |
378.428 g/mol |
| SMILES |
N(c1nc(C(=O)OCC)cc2c1ccc(OC)c2OCC=C)c1ccccc1 |
| SPLASH |
splash10-002r-0009000000-c11f3c40a48d8a383a63 |
| Source of Spectrum |
J-55-6146-24 |
| Wiley ID |
1358849 |
