Vitas-M small molecule compound
ethyl 2-(4-{[({[(1E)-1-chloroethylidene]amino}oxy)carbonyl](methyl)amino}phenyl)-3,3,3-trifluoro-2-hydroxypropanoate
Catalog ID
STL323208
SMILES CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)N(C(=O)O/N=C(/Cl)\C)C)O
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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 C15H16ClF3N2O5 MW 396.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16ClF3N2O5/c1-4-25-12(22)14(24,15(17,18)19)10-5-7-11(8-6-10)21(3)13(23)26-20-9(2)16/h5-8,24H,4H2,1-3H3/b20-9+InChIKey
KMDSPZIRLHLQBI-AWQFTUOYSA-NSynonyms
317841-96-6(E)ethyl2(4(((((1chloroethylidene)amino)oxy)carbonyl)(methyl)amino)phenyl)333trifluoro2hydroxypropanoate
317841966
CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)N(C(=O)ON=C(Cl)C)C)O
CCOC(=O)C(C1=CC=C(C=C1)N(C)C(=O)ON=C(C)Cl)(C(F)(F)F)O
ethyl2(4((((((1E)1chloroethylidene)amino)oxy)carbonyl)(methyl)amino)phenyl)333trifluoro2hydroxypropanoate
ethyl2(4(((E)1chloroethylideneamino)oxycarbonylmethylamino)phenyl)333trifluoro2hydroxypropanoate
InChI=1SC15H16ClF3N2O5c142512(22)14(2415(1718)19)105711(8610)21(3)13(23)26209(2)16h5824H4H213H3b209+
MFCD00850899
ZINC000100681985
ZINC000100681988
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