| SpectraBase Spectrum ID |
6mZO7rBlQsc |
| Name |
(E)-2-[3-(2-Chlorophenyl)isoxazol-5-yl]methylene-5-oxohexanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14ClNO4 |
| InChI |
InChI=1S/C16H14ClNO4/c1-10(19)6-7-11(16(20)21)8-12-9-15(18-22-12)13-4-2-3-5-14(13)17/h2-5,8-9H,6-7H2,1H3,(H,20,21)/b11-8+ |
| InChIKey |
JTRCQPPTXZDEQK-DHZHZOJOSA-N |
| Molecular Weight |
319.744 g/mol |
| SMILES |
OC(\C(=C\c1cc(no1)-c1c(Cl)cccc1)CCC(=O)C)=O |
| SPLASH |
splash10-004i-0095000000-be79e36be06c21419bee |
| Source of Spectrum |
SO-0-279-12 |
| Synonyms |
(2E)-3-[3-(2-chlorophenyl)-5-isoxazolyl]-2-(3-oxobutyl)-2-propenoic acid |
| Wiley ID |
864140 |
![(E)-2-[3-(2-Chlorophenyl)isoxazol-5-yl]methylene-5-oxohexanoic acid](/api/spectrum/6mZO7rBlQsc/structure.png?h=300&w=458 "(E)-2-[3-(2-Chlorophenyl)isoxazol-5-yl]methylene-5-oxohexanoic acid")
