SpectraBase Spectrum ID |
LqzyQH3PmTJ |
Name |
4-Hydroxybenzaldehyde [1,3-dimethyl-7-(1-naphthylmethyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
454.175338589 u |
Formula |
C25H22N6O3 |
InChI |
InChI=1S/C25H22N6O3/c1-29-22-21(23(33)30(2)25(29)34)31(15-18-8-5-7-17-6-3-4-9-20(17)18)24(27-22)28-26-14-16-10-12-19(32)13-11-16/h3-14,32H,15H2,1-2H3,(H,27,28)/b26-14+ |
InChIKey |
GDNMHJLFSDFWEP-VULFUBBASA-N |
Molecular Weight |
454.490 g/mol |
SMILES |
N(C1=NC2=C(N1CC=1C=3C(=CC=CC3)C=CC1)C(=O)N(C(N2C)=O)C)\N=C\C1=CC=C(C=C1)O |