SpectraBase Spectrum ID |
DIxS1oKioI8 |
Name |
Pyrano[2,3-C]pyrazole-5-carbonitrile, 6-amino-3-(1,3-benzodioxol-5-yl)-1,4-dihydro-4-(4-hydroxyphenyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
374.101504943 u |
Formula |
C20H14N4O4 |
InChI |
InChI=1S/C20H14N4O4/c21-8-13-16(10-1-4-12(25)5-2-10)17-18(23-24-20(17)28-19(13)22)11-3-6-14-15(7-11)27-9-26-14/h1-7,16,25H,9,22H2,(H,23,24) |
InChIKey |
QDIYNLUMYXOLLL-UHFFFAOYSA-N |
Molecular Weight |
374.356 g/mol |
SMILES |
OC1=CC=C(C2C3=C(OC(=C2C#N)N)NN=C3C2=CC=3OCOC3C=C2)C=C1 |