Vitas-M small molecule compound

2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl 4-(trifluoromethyl)benzoate

Catalog ID
STL186692
SMILES O=C(NCc1ccc2c(c1)OCO2)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 C18H14F3NO5 MW 381.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3NO5/c19-18(20,21)13-4-2-12(3-5-13)17(24)25-9-16(23)22-8-11-1-6-14-15(7-11)27-10-26-14/h1-7H,8-10H2,(H,22,23)
InChIKey
YPSLYGRVYPGINE-UHFFFAOYSA-N
Synonyms

(2(13BENZODIOXOL5YLMETHYLAMINO)2OXOETHYL)4(TRIFLUOROMETHYL)BENZOATE
2((13benzodioxol5ylmethyl)amino)2oxoethyl4(trifluoromethyl)benzoate
C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C3=CC=C(C=C3)C(F)(F)F
InChI=1SC18H14F3NO5c1918(2021)134212(3513)17(24)25916(23)22811161415(711)27102614h17H810H2(H2223)
MFCD05277364
ZINC000005980786
ZINC5980786

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Available files

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