Vitas-M small molecule compound
2-[(2-fluorophenyl)amino]-2-oxoethyl 4-(trifluoromethyl)benzoate
Catalog ID
STL186656
SMILES O=C(Nc1ccccc1F)COC(=O)c1ccc(cc1)C(F)(F)F
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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 C16H11F4NO3 MW 341.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F4NO3/c17-12-3-1-2-4-13(12)21-14(22)9-24-15(23)10-5-7-11(8-6-10)16(18,19)20/h1-8H,9H2,(H,21,22)InChIKey
LJYJTGDRKJHFMT-UHFFFAOYSA-NSynonyms
(2(2FLUOROANILINO)2OXOETHYL)4(TRIFLUOROMETHYL)BENZOATE
2((2fluorophenyl)amino)2oxoethyl4(trifluoromethyl)benzoate
C1=CC=C(C(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C(F)(F)F)F
InChI=1SC16H11F4NO3c1712312413(12)2114(22)92415(23)105711(8610)16(1819)20h18H9H2(H2122)
MFCD05277382
ZINC000005980803
ZINC5980803
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