Vitas-M small molecule compound
3-[(phenylcarbonyl)oxy]-1-propyl-1-azoniabicyclo[2.2.2]octane
Catalog ID
STK697906
SMILES CCC[N+]12CCC(CC1)C(C2)OC(=O)c1ccccc1
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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 C17H24NO2 MW 274.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24NO2/c1-2-10-18-11-8-14(9-12-18)16(13-18)20-17(19)15-6-4-3-5-7-15/h3-7,14,16H,2,8-13H2,1H3/q+1InChIKey
DUTZWTYVTLUFKY-UHFFFAOYSA-NSynonyms
(1PROPYL1AZONIABICYCLO(222)OCTAN3YL)BENZOATE
(1s4r)3(benzoyloxy)1propylquinuclidin1iumbromide
3((phenylcarbonyl)oxy)1propyl1azoniabicyclo(222)octane
CCC(N@+)12CC(C@H)(CC1)C(C2)OC(=O)c1ccccc1(Br)
CCC(N+)12CCC(CC1)C(C2)OC(=O)c1ccccc1
CCC(N+)12CCC(CC1)C(C2)OC(=O)C3=CC=CC=C3
InChI=1SC17H24NO2c12101811814(91218)16(1318)2017(19)156435715h371416H2813H21H3q+1
MFCD03010137
ZINC000000548099
ZINC000000548101
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