Vitas-M small molecule compound

ethyl 4-(3-fluorophenyl)-2,5-dioxo-7-phenyl-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate

Catalog ID
STK686755
SMILES CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)c1cccc(c1)F)c1ccccc1

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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 C24H22FNO4 MW 407.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FNO4/c1-2-30-24(29)22-17(14-7-4-3-5-8-14)12-19-21(23(22)28)18(13-20(27)26-19)15-9-6-10-16(25)11-15/h3-11,17-18,22H,2,12-13H2,1H3,(H,26,27)
InChIKey
KKUUBILUKHOVEW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1C(CC2=C(C1=O)C(CC(=O)N2)C3=CC(=CC=C3)F)C4=CC=CC=C4
ethyl4(3fluorophenyl)25dioxo7phenyl12345678octahydroquinoline6carboxylate
ethyl4(3fluorophenyl)25dioxo7phenyl134678hexahydroquinoline6carboxylate
InChI=1SC24H22FNO4c123024(29)2217(147435814)121921(23(22)28)18(1320(27)2619)15961016(25)1115h311171822H21213H21H3(H2627)
MFCD06017423
ZINC000004728094
ZINC000014944707

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Available files

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