Vitas-M small molecule compound

1-{2-[(2,4-dimethylcyclohexyl)methoxy]-2-oxoethyl}-1-methylpiperidinium

Catalog ID
STK015704
SMILES CC1CCC(C(C1)C)COC(=O)C[N+]1(C)CCCCC1

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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 C17H32NO2 MW 282.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H32NO2/c1-14-7-8-16(15(2)11-14)13-20-17(19)12-18(3)9-5-4-6-10-18/h14-16H,4-13H2,1-3H3/q+1
InChIKey
DPGGKDIWMDCOAY-UHFFFAOYSA-N
Synonyms

(24DIMETHYLCYCLOHEXYL)METHYL2(1METHYLPIPERIDIN1IUM1YL)ACETATE
1(2(((1R2S4S)24DIMETHYLCYCLOHEXYL)METHOXY)2OXOETHYL)1METHYLPIPERIDINIUM
1(2((24dimethylcyclohexyl)methoxy)2oxoethyl)1methylpiperidin1iumiodide
1(2((24DIMETHYLCYCLOHEXYL)METHOXY)2OXOETHYL)1METHYLPIPERIDINIUM
CC1CCC(C(C1)C)COC(=O)C(N+)1(C)CCCCC1
CC1CCC(C(C1)C)COC(=O)C(N+)1(C)CCCCC1(I)
CC1CCC(C(C1)C)COC(=O)C(N+)2(CCCCC2)C
InChI=1SC17H32NO2c1147816(15(2)1114)132017(19)1218(3)95461018h1416H413H213H3q+1
MFCD03666454
STK015704
ZINC000004184541
ZINC000012556040

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Available files

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