Vitas-M small molecule compound

methyl 4-[(4-fluorophenyl)amino]-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate

Catalog ID
STK773151
SMILES COC(=O)C1C(=O)C=C(CC1c1ccccc1)Nc1ccc(cc1)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 C20H18FNO3 MW 339.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FNO3/c1-25-20(24)19-17(13-5-3-2-4-6-13)11-16(12-18(19)23)22-15-9-7-14(21)8-10-15/h2-10,12,17,19,22H,11H2,1H3
InChIKey
YMMJJEPPIBRKRX-UHFFFAOYSA-N
Synonyms

COC(=O)C1C(CC(=CC1=O)NC2=CC=C(C=C2)F)C3=CC=CC=C3
InChI=1SC20H18FNO3c12520(24)1917(135324613)1116(1218(19)23)22159714(21)81015h21012171922H11H21H3
methyl4((4fluorophenyl)amino)2oxo6phenylcyclohex3ene1carboxylate
METHYL4(4FLUOROANILINO)2OXO6PHENYLCYCLOHEX3ENE1CARBOXYLATE
MFCD03821343
ZINC000000109135
ZINC000000109154
ZINC00109135
ZINC00109141
ZINC00109154

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Available files

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