Vitas-M small molecule compound
ethyl 5-(4-methoxy-2-nitrophenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Catalog ID
STK997130
SMILES CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1[N+](=O)[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 C15H14N4O7 MW 362.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O7/c1-3-26-15(22)12-10-11(16-17-12)14(21)18(13(10)20)8-5-4-7(25-2)6-9(8)19(23)24/h4-6,10-11,16H,3H2,1-2H3InChIKey
MYUAPUCZCULGHQ-UHFFFAOYSA-NSynonyms
1023573-25-21023573252
CCOC(=O)C1=NNC2C1C(=O)N(C2=O)c1ccc(cc1(N+)(=O)(O))OC
CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=C(C=C(C=C3)OC)(N+)(=O)(O)
ethyl5(4methoxy2nitrophenyl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
ETHYL5(4METHOXY2NITROPHENYL)46DIOXO3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE3CARBOXYLATE
InChI=1SC15H14N4O7c132615(22)121011(161712)14(21)18(13(10)20)8547(252)69(8)19(23)24h46101116H3H212H3
MFCD03690477
ZINC000009462521
ZINC000101013239
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