Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-[(3-fluoro-4-methylphenyl)amino]prop-2-en-1-one
Catalog ID
STK902296
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/Nc1ccc(c(c1)F)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H14FNO3 MW 299.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14FNO3/c1-11-2-4-13(9-14(11)18)19-7-6-15(20)12-3-5-16-17(8-12)22-10-21-16/h2-9,19H,10H2,1H3/b7-6+InChIKey
HDBWFSBQXWJFJL-VOTSOKGWSA-NSynonyms
(2E)1(13benzodioxol5yl)3((3fluoro4methylphenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(3fluoro4methylanilino)prop2en1one
CC1=C(C=C(C=C1)NC=CC(=O)C2=CC3=C(C=C2)OCO3)F
InChI=1SC17H14FNO3c1112413(914(11)18)197615(20)12351617(812)22102116h2919H10H21H3b76+
MFCD18174822
O=C(c1ccc2c(c1)OCO2)C=CNc1ccc(c(c1)F)C
ZINC000044842725
ZINC44842725
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