Vitas-M small molecule compound

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

Catalog ID
STK433617
SMILES CCC1CCCCN1C(=O)c1ccc(cc1[N+](=O)[O-])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 C14H17ClN2O3 MW 296.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17ClN2O3/c1-2-11-5-3-4-8-16(11)14(18)12-7-6-10(15)9-13(12)17(19)20/h6-7,9,11H,2-5,8H2,1H3
InChIKey
ZDAGWBLWAUAACD-UHFFFAOYSA-N
Synonyms
560099-22-1
(4chloro2nitrophenyl)(2ethylpiperidin1yl)methanone
1(4CHLORO2NITROBENZOYL)2ETHYLPIPERIDINE
4CHLORO2NITROPHENYL2ETHYLPIPERIDYLKETONE
560099221
CCC1CCCCN1C(=O)c1ccc(cc1(N+)(=O)(O))Cl
CCC1CCCCN1C(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O)
InChI=1SC14H17ClN2O3c1211534816(11)14(18)127610(15)913(12)17(19)20h67911H258H21H3
MFCD03384483
ZINC000000376378
ZINC000000376379

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Available files

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