Vitas-M small molecule compound

methyl 2-cyclopentyl-3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}propanoate

Catalog ID
STK037879
SMILES COC(=O)C(C(=O)Nc1cccc(c1)C(F)(F)F)C1CCCC1

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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 C16H18F3NO3 MW 329.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18F3NO3/c1-23-15(22)13(10-5-2-3-6-10)14(21)20-12-8-4-7-11(9-12)16(17,18)19/h4,7-10,13H,2-3,5-6H2,1H3,(H,20,21)
InChIKey
CUEAQSJGBVEBKG-UHFFFAOYSA-N
Synonyms

COC(=O)C(C(=O)Nc1cccc(c1)C(F)(F)F)C1CCCC1
COC(=O)C(C1CCCC1)C(=O)NC2=CC=CC(=C2)C(F)(F)F
InChI=1SC16H18F3NO3c12315(22)13(10523610)14(21)201284711(912)16(1718)19h471013H2356H21H3(H2021)
METHYL(2S)2CYCLOPENTYL3OXO3((3(TRIFLUOROMETHYL)PHENYL)AMINO)PROPANOATE
METHYL2CYCLOPENTYL3OXO3((3(TRIFLUOROMETHYL)PHENYL)AMINO)PROPANOATE
METHYL2CYCLOPENTYL3OXO3(3(TRIFLUOROMETHYL)ANILINO)PROPANOATE
MFCD03712433
STK037879
ZINC000001163948
ZINC000001163949

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.