Vitas-M small molecule compound
(2Z)-3-(1,3-dimethyl-1H-pyrazol-5-yl)-2-nitro-1-phenylprop-2-en-1-one
Catalog ID
STL403321
SMILES Cc1nn(c(c1)/C=C(/C(=O)c1ccccc1)\[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 C14H13N3O3 MW 271.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O3/c1-10-8-12(16(2)15-10)9-13(17(19)20)14(18)11-6-4-3-5-7-11/h3-9H,1-2H3/b13-9-InChIKey
KKVNCULOPFMELO-LCYFTJDESA-NSynonyms
1005700-92-4(2Z)3(13dimethyl1Hpyrazol5yl)2nitro1phenylprop2en1one
(Z)3(25DIMETHYLPYRAZOL3YL)2NITRO1PHENYLPROP2EN1ONE
1005700924
CC1=NN(C(=C1)C=C(C(=O)C2=CC=CC=C2)(N+)(=O)(O))C
Cc1nn(c(c1)C=C(C(=O)c1ccccc1)(N+)(=O)(O))C
InChI=1SC14H13N3O3c110812(16(2)1510)913(17(19)20)14(18)116435711h39H12H3b139
MFCD04046867
ZINC000006527835
ZINC06527835
ZINC6527835
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