Vitas-M small molecule compound

methyl 5-(2,5-dimethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STK825637
SMILES COc1ccc(c(c1)N1C(=O)C2C(C1=O)C(=NN2)C(=O)OC)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 C15H15N3O6 MW 333.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O6/c1-22-7-4-5-9(23-2)8(6-7)18-13(19)10-11(14(18)20)16-17-12(10)15(21)24-3/h4-6,10-11,16H,1-3H3
InChIKey
NQGHPPCPHMBYPL-UHFFFAOYSA-N
Synonyms
344956-88-3
344956883
COC1=CC(=C(C=C1)OC)N2C(=O)C3C(C2=O)NN=C3C(=O)OC
InChI=1SC15H15N3O6c1227459(232)8(67)1813(19)1011(14(18)20)161712(10)15(21)243h46101116H13H3
methyl5(25dimethoxyphenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(25DIMETHOXYPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD01188396
ZINC000004852585
ZINC000100559237

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Available files

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