Vitas-M small molecule compound
1-[2-(acetyloxy)-2-phenylethyl]-1-methylazepanium
Catalog ID
STK825496
SMILES CC(=O)OC(c1ccccc1)C[N+]1(C)CCCCCC1
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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/c1-15(19)20-17(16-10-6-5-7-11-16)14-18(2)12-8-3-4-9-13-18/h5-7,10-11,17H,3-4,8-9,12-14H2,1-2H3/q+1InChIKey
TWZTWUWHHWIWNW-UHFFFAOYSA-NSynonyms
(2(1METHYLAZEPAN1IUM1YL)1PHENYLETHYL)ACETATE
(2(1METHYLAZEPAN1IUM1YL)1PHENYLETHYL)ACETATEIODIDE
(2(1METHYLAZEPAN1IUM1YL)1PHENYLETHYL)ETHANOATEIODIDE
1(2(acetyloxy)2phenylethyl)1methylazepanium
1(2acetoxy2phenylethyl)1methylazepan1iumiodide
ACETICACID(2(1METHYL1AZEPAN1IUMYL)1PHENYLETHYL)ESTERIODIDE
ACETICACID(2(1METHYLAZEPAN1IUM1YL)1PHENYLETHYL)ESTERIODIDE
CC(=O)OC(C(N+)1(CCCCCC1)C)C2=CC=CC=C2
CC(=O)OC(c1ccccc1)C(N+)1(C)CCCCCC1
CC(=O)OC(c1ccccc1)C(N+)1(C)CCCCCC1(I)
InChI=1SC17H26NO2c115(19)2017(16106571116)1418(2)1283491318h57101117H34891214H212H3q+1
ZINC000000185815
ZINC000000185817
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