Vitas-M small molecule compound
2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
Catalog ID
STL187764
SMILES O=C(Nc1ccccc1C(F)(F)F)COC(=O)C1COc2c(O1)cccc2
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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 C18H14F3NO5 MW 381.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3NO5/c19-18(20,21)11-5-1-2-6-12(11)22-16(23)10-26-17(24)15-9-25-13-7-3-4-8-14(13)27-15/h1-8,15H,9-10H2,(H,22,23)InChIKey
JORXUJZLHCMQFY-UHFFFAOYSA-NSynonyms
(2oxo2(2(trifluoromethyl)anilino)ethyl)23dihydro14benzodioxine3carboxylate
2oxo2((2(trifluoromethyl)phenyl)amino)ethyl23dihydro14benzodioxine2carboxylate
C1C(OC2=CC=CC=C2O1)C(=O)OCC(=O)NC3=CC=CC=C3C(F)(F)F
InChI=1SC18H14F3NO5c1918(2021)11512612(11)2216(23)102617(24)1592513734814(13)2715h1815H910H2(H2223)
MFCD05318205
ZINC000003497920
ZINC000003497922
ZINC03497920
ZINC03497922
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