Vitas-M small molecule compound

N,N,N-trimethyl-3-{[(3-methyl-1-benzofuran-2-yl)carbonyl]oxy}butan-1-aminium

Catalog ID
STK096056
SMILES CC(OC(=O)c1oc2c(c1C)cccc2)CC[N+](C)(C)C

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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 C17H24NO3 MW 290.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24NO3/c1-12(10-11-18(3,4)5)20-17(19)16-13(2)14-8-6-7-9-15(14)21-16/h6-9,12H,10-11H2,1-5H3/q+1
InChIKey
RWZOXMFVUMITHO-UHFFFAOYSA-N
Synonyms

(3R)NNNTRIMETHYL3(((3METHYL1BENZOFURAN2YL)CARBONYL)OXY)BUTAN1AMINIUM
CC(OC(=O)c1oc2c(c1C)cccc2)CC(N+)(C)(C)C
CC(OC(=O)c1oc2c(c1C)cccc2)CC(N+)(C)(C)C(I)
CC1=C(OC2=CC=CC=C12)C(=O)OC(C)CC(N+)(C)(C)C
InChI=1SC17H24NO3c112(101118(34)5)2017(19)1613(2)14867915(14)2116h6912H1011H215H3q+1
MFCD01545172
NNNTRIMETHYL3(((3METHYL1BENZOFURAN2YL)CARBONYL)OXY)BUTAN1AMINIUM
NNNtrimethyl3((3methylbenzofuran2carbonyl)oxy)butan1aminiumiodide
STK096056
TRIMETHYL(3(3METHYL1BENZOFURAN2CARBONYL)OXYBUTYL)AZANIUM
TRIMETHYL(3(3METHYLBENZOFURAN2CARBONYLOXY)BUTYL)AMMONIUM
ZINC000001755799
ZINC000001755801

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Available files

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