Vitas-M small molecule compound

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

Catalog ID
STK785683
SMILES COC(=O)C1=NNC2(C1)CC(=O)N(C2=O)c1ccc(cc1)C

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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 C15H15N3O4 MW 301.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O4/c1-9-3-5-10(6-4-9)18-12(19)8-15(14(18)21)7-11(16-17-15)13(20)22-2/h3-6,17H,7-8H2,1-2H3
InChIKey
JKNDGDXOARNXTM-UHFFFAOYSA-N
Synonyms
477248-43-4
477248434
CC1=CC=C(C=C1)N2C(=O)CC3(C2=O)CC(=NN3)C(=O)OC
InChI=1SC15H15N3O4c193510(649)1812(19)815(14(18)21)711(161715)13(20)222h3617H78H212H3
methyl68dioxo7(ptolyl)127triazaspiro(44)non2ene3carboxylate
methyl7(4methylphenyl)68dioxo127triazaspiro(44)non2ene3carboxylate
METHYL8(4METHYLPHENYL)79DIOXO348TRIAZASPIRO(44)NON2ENE2CARBOXYLATE
MFCD03303270
ZINC000000552013
ZINC000004786490

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Available files

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