Vitas-M small molecule compound

methyl 2-(4-{[({[(1E)-1-chlorobutylidene]amino}oxy)carbonyl](methyl)amino}phenyl)-3,3,3-trifluoro-2-hydroxypropanoate

Catalog ID
STL323047
SMILES CCC/C(=N\OC(=O)N(c1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O)C)/Cl

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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 C16H18ClF3N2O5 MW 410.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClF3N2O5/c1-4-5-12(17)21-27-14(24)22(2)11-8-6-10(7-9-11)15(25,13(23)26-3)16(18,19)20/h6-9,25H,4-5H2,1-3H3/b21-12+
InChIKey
XZUCFJYKJYAWJY-CIAFOILYSA-N
Synonyms
354772-31-9
(E)methyl2(4(((((1chlorobutylidene)amino)oxy)carbonyl)(methyl)amino)phenyl)333trifluoro2hydroxypropanoate
354772319
CCCC(=NOC(=O)N(C)C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)Cl
CCCC(=NOC(=O)N(c1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O)C)Cl
InChI=1SC16H18ClF3N2O5c14512(17)212714(24)22(2)118610(7911)15(2513(23)263)16(1819)20h6925H45H213H3b2112+
methyl2(4((((((1E)1chlorobutylidene)amino)oxy)carbonyl)(methyl)amino)phenyl)333trifluoro2hydroxypropanoate
METHYL2(4(((E)1CHLOROBUTYLIDENEAMINO)OXYCARBONYLMETHYLAMINO)PHENYL)333TRIFLUORO2HYDROXYPROPANOATE
MFCD00852072
ZINC000100680508
ZINC000100680510

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Available files

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