Vitas-M small molecule compound

N,N,N,2,2-pentamethyl-3-{[(5-methyl-1-benzofuran-2-yl)carbonyl]oxy}propan-1-aminium

Catalog ID
STL058942
SMILES Cc1ccc2c(c1)cc(o2)C(=O)OCC(C[N+](C)(C)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 C18H26NO3 MW 304.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26NO3/c1-13-7-8-15-14(9-13)10-16(22-15)17(20)21-12-18(2,3)11-19(4,5)6/h7-10H,11-12H2,1-6H3/q+1
InChIKey
FTUVEGJFKBYQKW-UHFFFAOYSA-N
Synonyms

(22DIMETHYL3(5METHYL1BENZOFURAN2CARBONYL)OXYPROPYL)TRIMETHYLAZANIUM
(22DIMETHYL3(5METHYLBENZOFURAN2CARBONYLOXY)PROPYL)TRIMETHYLAMMONIUM
22DIMETHYL3(TRIMETHYLAMINO)PROPYL5METHYLBENZO(D)FURAN2CARBOXYLATE
CC1=CC2=C(C=C1)OC(=C2)C(=O)OCC(C)(C)C(N+)(C)(C)C
Cc1ccc2c(c1)cc(o2)C(=O)OCC(C(N+)(C)(C)C)(C)C
Cc1ccc2c(c1)cc(o2)C(=O)OCC(C(N+)(C)(C)C)(C)C(I)
InChI=1SC18H26NO3c113781514(913)1016(2215)17(20)211218(23)1119(45)6h710H1112H216H3q+1
NNN22pentamethyl3(((5methyl1benzofuran2yl)carbonyl)oxy)propan1aminium
NNN22pentamethyl3((5methylbenzofuran2carbonyl)oxy)propan1aminiumiodide
ZINC000001834794
ZINC01834794
ZINC1834794

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Available files

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