Vitas-M small molecule compound

3-nitro-4-(piperidin-1-yl)benzonitrile

Catalog ID
STK412472
SMILES N#Cc1ccc(c(c1)[N+](=O)[O-])N1CCCCC1

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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 C12H13N3O2 MW 231.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O2/c13-9-10-4-5-11(12(8-10)15(16)17)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7H2
InChIKey
NVYLIFFJNJWOSE-UHFFFAOYSA-N
Synonyms
32117-03-6
32117036
3nitro4(piperidin1yl)benzonitrile
3NITRO4PIPERIDIN1YLBENZONITRILE
3NITRO4PIPERIDYLBENZENECARBONITRILE
C1CCN(CC1)C2=C(C=C(C=C2)C#N)(N+)(=O)(O)
InChI=1SC12H13N3O2c139104511(12(810)15(16)17)146213714h458H1367H2
MFCD01529715
N#Cc1ccc(c(c1)(N+)(=O)(O))N1CCCCC1
ZINC000005394751
ZINC05394751
ZINC5394751

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Available files

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