Vitas-M small molecule compound
(2E)-1-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(4-nitrophenyl)prop-2-en-1-one
Catalog ID
STK439584
SMILES Cc1nn(c(c1)C)C(=O)/C=C/c1ccc(cc1)[N+](=O)[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 C14H13N3O3 MW 271.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O3/c1-10-9-11(2)16(15-10)14(18)8-5-12-3-6-13(7-4-12)17(19)20/h3-9H,1-2H3/b8-5+InChIKey
FZJQTMBKHARVKM-VMPITWQZSA-NSynonyms
(2E)1(35dimethyl1Hpyrazol1yl)3(4nitrophenyl)prop2en1one
(2E)1(35DIMETHYLPYRAZOLYL)3(4NITROPHENYL)PROP2EN1ONE
(E)1(35DIMETHYLPYRAZOL1YL)3(4NITROPHENYL)PROP2EN1ONE
CC1=CC(=NN1C(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))C
Cc1nn(c(c1)C)C(=O)C=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC14H13N3O3c110911(2)16(1510)14(18)85123613(7412)17(19)20h39H12H3b85+
MFCD03386786
ZINC000004894216
ZINC04894216
ZINC4894216
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