Vitas-M small molecule compound

methyl 2-amino-4-(2-fluorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STK788738
SMILES COC(=O)C1=C(N)OC2=C(C1c1ccccc1F)C(=O)CCC2

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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 C17H16FNO4 MW 317.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FNO4/c1-22-17(21)15-13(9-5-2-3-6-10(9)18)14-11(20)7-4-8-12(14)23-16(15)19/h2-3,5-6,13H,4,7-8,19H2,1H3
InChIKey
XCJJPZWYQUMZQC-UHFFFAOYSA-N
Synonyms
309926-74-7
309926747
COC(=O)C1=C(OC2=C(C1C3=CC=CC=C3F)C(=O)CCC2)N
InChI=1SC17H16FNO4c12217(21)1513(9523610(9)18)1411(20)74812(14)2316(15)19h235613H47819H21H3
methyl2amino4(2fluorophenyl)5oxo4678tetrahydrochromene3carboxylate
METHYL2AMINO4(2FLUOROPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBOXYLATE
methyl2amino4(2fluorophenyl)5oxo5678tetrahydro4Hchromene3carboxylate
MFCD00824332
ZINC000000062228
ZINC000000062229

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Available files

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