Vitas-M small molecule compound
4-(4-chloro-3,5-dimethylphenoxy)-5-nitrobenzene-1,2-dicarbonitrile
Catalog ID
STK138118
SMILES N#Cc1cc([N+](=O)[O-])c(cc1C#N)Oc1cc(C)c(c(c1)C)Cl
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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 C16H10ClN3O3 MW 327.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10ClN3O3/c1-9-3-13(4-10(2)16(9)17)23-15-6-12(8-19)11(7-18)5-14(15)20(21)22/h3-6H,1-2H3InChIKey
OKSOFBGJIOFMKN-UHFFFAOYSA-NSynonyms
4(4CHLORO35DIMETHYLPHENOXY)5NITROBENZENE12DICARBONITRILE
4(4chloro35dimethylphenoxy)5nitrophthalonitrile
CC1=CC(=CC(=C1Cl)C)OC2=C(C=C(C(=C2)C#N)C#N)(N+)(=O)(O)
InChI=1SC16H10ClN3O3c19313(410(2)16(9)17)2315612(819)11(718)514(15)20(21)22h36H12H3
MFCD01883335
N#Cc1cc((N+)(=O)(O))c(cc1C#N)Oc1cc(C)c(c(c1)C)Cl
ZINC000000082313
ZINC00082313
ZINC82313
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