| SpectraBase Spectrum ID |
2OrNXKLx3Cg |
| Name |
6-Iodo-3-(3-methoxyphenyl)-2-[(E)-2-(2-pyridinyl)ethenyl]-4(3H)-quinazolinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
481.028721765 u |
| Formula |
C22H16IN3O2 |
| InChI |
InChI=1S/C22H16IN3O2/c1-28-18-7-4-6-17(14-18)26-21(11-9-16-5-2-3-12-24-16)25-20-10-8-15(23)13-19(20)22(26)27/h2-14H,1H3/b11-9+ |
| InChIKey |
CBAURIJPZJICKQ-PKNBQFBNSA-N |
| Molecular Weight |
481.293 g/mol |
| SMILES |
C=1C=CN=C(\C=C\C=2N(C(C=3C=C(I)C=CC3N2)=O)C=2C=C(OC)C=CC2)C1 |