| SpectraBase Spectrum ID |
5KZa38hYveT |
| Name |
3-(3-Hydroxypropyl)-6-iodo-2-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-4(3H)-quinazolinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
485.060021894 u |
| Formula |
C22H20IN3O2 |
| InChI |
InChI=1S/C22H20IN3O2/c1-25-14-15(17-5-2-3-6-20(17)25)7-10-21-24-19-9-8-16(23)13-18(19)22(28)26(21)11-4-12-27/h2-3,5-10,13-14,27H,4,11-12H2,1H3/b10-7+ |
| InChIKey |
CUOBXPQQHXHBKA-JXMROGBWSA-N |
| Molecular Weight |
485.325 g/mol |
| SMILES |
OCCCN1C(C2=CC(I)=CC=C2N=C1\C=C\C1=CN(C)C2=C1C=CC=C2)=O |
![3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-4(3H)-quinazolinone](/api/spectrum/5KZa38hYveT/structure.png?h=300&w=458 "3-(3-hydroxypropyl)-6-iodo-2-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-4(3H)-quinazolinone")
