Vitas-M small molecule compound

2,4-dimethyl-6-(phenylcarbamoyl)cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK023037
SMILES CC1=CC(C)C(C(C1)C(=O)Nc1ccccc1)C(=O)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 C16H19NO3 MW 273.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO3/c1-10-8-11(2)14(16(19)20)13(9-10)15(18)17-12-6-4-3-5-7-12/h3-8,11,13-14H,9H2,1-2H3,(H,17,18)(H,19,20)
InChIKey
UQLNUTIWPXTVGO-UHFFFAOYSA-N
Synonyms
485395-31-1
24DIMETHYL6(PHENYLCARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
24dimethyl6(phenylcarbamoyl)cyclohex3enecarboxylicacid
24DIMETHYL6PHENYLCARBAMOYLCYCLOHEX3ENECARBOXYLICACID
485395311
CC1=CC(C)C(C(C1)C(=O)Nc1ccccc1)C(=O)O
CC1C=C(CC(C1C(=O)O)C(=O)NC2=CC=CC=C2)C
InChI=1SC16H19NO3c110811(2)14(16(19)20)13(910)15(18)17126435712h38111314H9H212H3(H1718)(H1920)
MFCD01025670
STK023037
ZINC000000185888
ZINC000169686037

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Available files

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