| SpectraBase Spectrum ID |
AyXQ7MsMdSO |
| Name |
6-Amino-3-(4-ethoxy-3-methoxy-phenyl)-4-(4-hydroxy-3-methoxy-phenyl)-2,4-dihydropyrano[2,3-C]pyrazole-5-carbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
434.159019819 u |
| Formula |
C23H22N4O5 |
| InChI |
InChI=1S/C23H22N4O5/c1-4-31-16-8-6-13(10-18(16)30-3)21-20-19(12-5-7-15(28)17(9-12)29-2)14(11-24)22(25)32-23(20)27-26-21/h5-10,19,28H,4,25H2,1-3H3,(H,26,27) |
| InChIKey |
DPLAIOFWHAKRBW-UHFFFAOYSA-N |
| Molecular Weight |
434.452 g/mol |
| SMILES |
C12=C(OC(=C(C2C2=CC(OC)=C(C=C2)O)C#N)N)NN=C1C=1C=C(OC)C(=CC1)OCC |