Vitas-M small molecule compound

{[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene}propanedinitrile

Catalog ID
STL380021
SMILES N#CC(=Cc1ccc(o1)c1cc(C)c(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 C16H11N3O3 MW 293.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N3O3/c1-10-5-14(15(19(20)21)6-11(10)2)16-4-3-13(22-16)7-12(8-17)9-18/h3-7H,1-2H3
InChIKey
WHGYGGMPGCXYEH-UHFFFAOYSA-N
Synonyms

((5(45DIMETHYL2NITROPHENYL)2FURYL)METHYLENE)METHANE11DICARBONITRILE
((5(45dimethyl2nitrophenyl)furan2yl)methylidene)propanedinitrile
2((5(45DIMETHYL2NITROPHENYL)FURAN2YL)METHYLIDENE)PROPANEDINITRILE
2(5(45DIMETHYL2NITROPHENYL)FURAN2YLMETHYLENE)MALONONITRILE
CC1=C(C=C(C(=C1)C2=CC=C(O2)C=C(C#N)C#N)(N+)(=O)(O))C
InChI=1SC16H11N3O3c110514(15(19(20)21)611(10)2)164313(2216)712(817)918h37H12H3
MFCD01784783
N#CC(=Cc1ccc(o1)c1cc(C)c(cc1(N+)(=O)(O))C)C#N
ZINC000000271250
ZINC00271250
ZINC271250

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Available files

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