Vitas-M small molecule compound
methyl 5-(3-nitrophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STL040677
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)[N+](=O)[O-])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 C13H9N5O7 MW 347.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N5O7/c1-25-13(21)9-8-10(17(14-9)15-22)12(20)16(11(8)19)6-3-2-4-7(5-6)18(23)24/h2-5,8,10H,1H3InChIKey
SCFRDJVEDKXJOP-UHFFFAOYSA-NSynonyms
1022231-97-51022231975
COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1cccc(c1)(N+)(=O)(O))N=O
COC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC(=CC=C3)(N+)(=O)(O))N=O
InChI=1SC13H9N5O7c12513(21)9810(17(149)1522)12(20)16(11(8)19)63247(56)18(23)24h25810H1H3
methyl5(3nitrophenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(3NITROPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03690192
ZINC000009328166
ZINC000101012667
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