Vitas-M small molecule compound
methyl 5-(4-methoxy-2-nitrophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK709754
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1C(=O)C2C(C1=O)C(=NN2)C(=O)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 C14H12N4O7 MW 348.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12N4O7/c1-24-6-3-4-7(8(5-6)18(22)23)17-12(19)9-10(13(17)20)15-16-11(9)14(21)25-2/h3-5,9-10,15H,1-2H3InChIKey
SOOULXXOYSGMCC-UHFFFAOYSA-NSynonyms
956242-18-5956242185
COC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)NN=C3C(=O)OC)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1C(=O)C2C(C1=O)C(=NN2)C(=O)OC
InChI=1SC14H12N4O7c1246347(8(56)18(22)23)1712(19)910(13(17)20)151611(9)14(21)252h3591015H12H3
methyl5(4methoxy2nitrophenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(4METHOXY2NITROPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD04174137
ZINC000009304228
ZINC000100166100
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