Vitas-M small molecule compound
4-(2,2-dicyanoethenyl)phenyl 1-methyl-4-nitro-1H-pyrazole-3-carboxylate
Catalog ID
STK758409
SMILES N#CC(=Cc1ccc(cc1)OC(=O)c1nn(cc1[N+](=O)[O-])C)C#N
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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 C15H9N5O4 MW 323.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9N5O4/c1-19-9-13(20(22)23)14(18-19)15(21)24-12-4-2-10(3-5-12)6-11(7-16)8-17/h2-6,9H,1H3InChIKey
RZNJDYDBCKLSDV-UHFFFAOYSA-NSynonyms
(4(22DICYANOETHENYL)PHENYL)1METHYL4NITROPYRAZOLE3CARBOXYLATE
4(22dicyanoethenyl)phenyl1methyl4nitro1Hpyrazole3carboxylate
4(22DICYANOVINYL)PHENYL1METHYL4NITRO1HPYRAZOLE3CARBOXYLATE
CN1C=C(C(=N1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C#N)(N+)(=O)(O)
InChI=1SC15H9N5O4c119913(20(22)23)14(1819)15(21)24124210(3512)611(716)817h269H1H3
MFCD01414622
N#CC(=Cc1ccc(cc1)OC(=O)c1nn(cc1(N+)(=O)(O))C)C#N
ZINC000000069427
ZINC00069427
ZINC69427
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