Vitas-M small molecule compound

(4-benzylpiperidin-1-yl)(2-chloro-4-nitrophenyl)methanone

Catalog ID
STK042201
SMILES Clc1cc(ccc1C(=O)N1CCC(CC1)Cc1ccccc1)[N+](=O)[O-]

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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 C19H19ClN2O3 MW 358.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3/c20-18-13-16(22(24)25)6-7-17(18)19(23)21-10-8-15(9-11-21)12-14-4-2-1-3-5-14/h1-7,13,15H,8-12H2
InChIKey
JQNNUDQIACWYOD-UHFFFAOYSA-N
Synonyms
313067-87-7
(4BENZYLPIPERIDIN1YL)(2CHLORO4NITROPHENYL)METHANONE
2CHLORO4NITROPHENYL4BENZYLPIPERIDYLKETONE
313067877
C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
Clc1cc(ccc1C(=O)N1CCC(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC19H19ClN2O3c20181316(22(24)25)6717(18)19(23)2110815(91121)12144213514h171315H812H2
MFCD00750856
STK042201
ZINC000001230536
ZINC01230536
ZINC1230536

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.