Vitas-M small molecule compound

4-methyl-6-{[4-(trifluoromethoxy)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK680934
SMILES O=C(C1CC(=CCC1C(=O)O)C)Nc1ccc(cc1)OC(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 C16H16F3NO4 MW 343.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F3NO4/c1-9-2-7-12(15(22)23)13(8-9)14(21)20-10-3-5-11(6-4-10)24-16(17,18)19/h2-6,12-13H,7-8H2,1H3,(H,20,21)(H,22,23)
InChIKey
XBNFYFUGSSJTKU-UHFFFAOYSA-N
Synonyms

4methyl6((4(trifluoromethoxy)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
CC1=CCC(C(C1)C(=O)NC2=CC=C(C=C2)OC(F)(F)F)C(=O)O
InChI=1SC16H16F3NO4c192712(15(22)23)13(89)14(21)20103511(6410)2416(1718)19h261213H78H21H3(H2021)(H2223)
MFCD03767756
ZINC000000106216
ZINC000000106225

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Available files

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