Vitas-M small molecule compound
methyl 4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzoate
Catalog ID
STL415022
SMILES COC(=O)c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])C
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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 C14H15N3O4 MW 289.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O4/c1-9-13(17(19)20)10(2)16(15-9)8-11-4-6-12(7-5-11)14(18)21-3/h4-7H,8H2,1-3H3InChIKey
GNQSONRTGCRWDC-UHFFFAOYSA-NSynonyms
879773-55-4879773554
CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)OC)C)(N+)(=O)(O)
COC(=O)c1ccc(cc1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC14H15N3O4c1913(17(19)20)10(2)16(159)8114612(7511)14(18)213h47H8H213H3
methyl4((35dimethyl4nitro1Hpyrazol1yl)methyl)benzoate
METHYL4((35DIMETHYL4NITROPYRAZOL1YL)METHYL)BENZOATE
METHYL4((35DIMETHYL4NITROPYRAZOLYL)METHYL)BENZOATE
MFCD08510537
ZINC000005346579
ZINC05346579
ZINC5346579
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