Vitas-M small molecule compound

1-methyl-1-[2-oxo-2-(3-phenylpropoxy)ethyl]piperidinium

Catalog ID
STK018584
SMILES O=C(C[N+]1(C)CCCCC1)OCCCc1ccccc1

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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 C17H26NO2 MW 276.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H26NO2/c1-18(12-6-3-7-13-18)15-17(19)20-14-8-11-16-9-4-2-5-10-16/h2,4-5,9-10H,3,6-8,11-15H2,1H3/q+1
InChIKey
MGXIJIYRPJRZOI-UHFFFAOYSA-N
Synonyms

1methyl1(2oxo2(3phenylpropoxy)ethyl)piperidin1iumiodide
1METHYL1(2OXO2(3PHENYLPROPOXY)ETHYL)PIPERIDINIUM
1METHYL1(3PHENYLPROPOXYCARBONYLMETHYL)PIPERIDINIUM
2(1METHYL1PIPERIDIN1IUMYL)ACETICACID3PHENYLPROPYLESTERIODIDE
2(1METHYLPIPERIDIN1IUM1YL)ACETICACID3PHENYLPROPYLESTERIODIDE
3PHENYLPROPYL2(1METHYLPIPERIDIN1IUM1YL)ACETATE
3PHENYLPROPYL2(1METHYLPIPERIDIN1IUM1YL)ACETATEIODIDE
3PHENYLPROPYL2(1METHYLPIPERIDIN1IUM1YL)ETHANOATEIODIDE
3PHENYLPROPYL2(METHYLPIPERIDYL)ACETATE
C(N+)1(CCCCC1)CC(=O)OCCCC2=CC=CC=C2
InChI=1SC17H26NO2c118(126371318)1517(19)20148111694251016h245910H3681115H21H3q+1
MFCD02711298
O=C(C(N+)1(C)CCCCC1)OCCCc1ccccc1
O=C(C(N+)1(C)CCCCC1)OCCCc1ccccc1(I)
STK018584
ZINC000001836424
ZINC01836424
ZINC1836424

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Available files

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