Vitas-M small molecule compound

ethyl 5-(3-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STK710062
SMILES CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1cccc(c1)OC

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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 C15H15N3O5 MW 317.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O5/c1-3-23-15(21)12-10-11(16-17-12)14(20)18(13(10)19)8-5-4-6-9(7-8)22-2/h4-7,10-11,16H,3H2,1-2H3
InChIKey
ZXMSFIQJVKQWGR-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=CC(=CC=C3)OC
ethyl5(3methoxyphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(3METHOXYPHENYL)46DIOXO353A6ATETRAHYDRO235TRIAZAPENTALENECARBOXYLATE
ETHYL5(3METHOXYPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H15N3O5c132315(21)121011(161712)14(20)18(13(10)19)85469(78)222h47101116H3H212H3
MFCD00685599
ZINC000018068888
ZINC000100048861

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Available files

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