SpectraBase Spectrum ID |
5HjsGQlHldb |
Name |
[3-(4-(Methoxyphenyl)-5-[4-nitrophenyl)isoxazol-4-yl](thiophene-2-yl)methanone |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H14N2O5S |
InChI |
InChI=1S/C21H14N2O5S/c1-27-16-10-6-13(7-11-16)19-18(20(24)17-3-2-12-29-17)21(28-22-19)14-4-8-15(9-5-14)23(25)26/h2-12H,1H3 |
InChIKey |
NZFKWVUAHAVOAH-UHFFFAOYSA-N |
Molecular Weight |
406.412 g/mol |
SMILES |
c1(c(onc1-c1ccc(cc1)OC)-c1ccc(N(=O)=O)cc1)C(c1sccc1)=O |
SPLASH |
splash10-0bt9-0900700000-2fa3ef3c0f9f835da71e |
Source of Spectrum |
F4-40-301-5n |
Wiley ID |
1670203 |