Vitas-M small molecule compound

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

Catalog ID
STL001642
SMILES CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)[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 C14H11N5O7 MW 361.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N5O7/c1-2-26-14(22)10-9-11(18(15-10)16-23)13(21)17(12(9)20)7-3-5-8(6-4-7)19(24)25/h3-6,9,11H,2H2,1H3
InChIKey
CQOUUWHVVWVIEL-UHFFFAOYSA-N
Synonyms
1022453-51-5
1022453515
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))N=O
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))N=O
ethyl5(4nitrophenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4NITROPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC14H11N5O7c122614(22)10911(18(1510)1623)13(21)17(12(9)20)7358(647)19(24)25h36911H2H21H3
MFCD03685555
ZINC000013711934
ZINC000101001299

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Available files

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