Vitas-M small molecule compound

methyl 7-(4-fluorophenyl)-1-nitroso-6,8-dioxo-1,2,7-triazaspiro[4.4]non-2-ene-3-carboxylate

Catalog ID
STL237390
SMILES COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)c1ccc(cc1)F)N=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 C14H11FN4O5 MW 334.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11FN4O5/c1-24-12(21)10-6-14(19(16-10)17-23)7-11(20)18(13(14)22)9-4-2-8(15)3-5-9/h2-5H,6-7H2,1H3
InChIKey
MOPHBSMWXDIKDO-UHFFFAOYSA-N
Synonyms
836636-06-7
836636067
COC(=O)C1=NN(C2(C1)CC(=O)N(C2=O)C3=CC=C(C=C3)F)N=O
InChI=1SC14H11FN4O5c12412(21)10614(19(1610)1723)711(20)18(13(14)22)9428(15)359h25H67H21H3
methyl7(4fluorophenyl)1nitroso68dioxo127triazaspiro(44)non2ene3carboxylate
METHYL8(4FLUOROPHENYL)4NITROSO79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
MFCD03689799
ZINC000005066161
ZINC000005066164

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Available files

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