Vitas-M small molecule compound
4-(4-methylpiperidin-1-yl)-3-nitrobenzonitrile
Catalog ID
STL289843
SMILES N#Cc1ccc(c(c1)[N+](=O)[O-])N1CCC(CC1)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 C13H15N3O2 MW 245.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O2/c1-10-4-6-15(7-5-10)12-3-2-11(9-14)8-13(12)16(17)18/h2-3,8,10H,4-7H2,1H3InChIKey
YNNCANUHEBGIOR-UHFFFAOYSA-NSynonyms
710967-13-84(4methylpiperidin1yl)3nitrobenzonitrile
4(4METHYLPIPERIDYL)3NITROBENZENECARBONITRILE
710967138
CC1CCN(CC1)C2=C(C=C(C=C2)C#N)(N+)(=O)(O)
InChI=1SC13H15N3O2c1104615(7510)123211(914)813(12)16(17)18h23810H47H21H3
MFCD04001196
N#Cc1ccc(c(c1)(N+)(=O)(O))N1CCC(CC1)C
ZINC000006388465
ZINC06388465
ZINC6388465
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