Vitas-M small molecule compound
1-(2-ethoxy-2-oxoethyl)-3-[(phenylcarbonyl)oxy]-1-azoniabicyclo[2.2.2]octane
Catalog ID
STL333560
SMILES CCOC(=O)C[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 C18H24NO4 MW 318.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24NO4/c1-2-22-17(20)13-19-10-8-14(9-11-19)16(12-19)23-18(21)15-6-4-3-5-7-15/h3-7,14,16H,2,8-13H2,1H3/q+1InChIKey
ZIAWRMHVMFDACK-UHFFFAOYSA-NSynonyms
(1(2ETHOXY2OXOETHYL)1AZONIABICYCLO(222)OCTAN3YL)BENZOATE
(1r4r)3(benzoyloxy)1(2ethoxy2oxoethyl)quinuclidin1iumbromide
(3R)3(BENZOYLOXY)1(2ETHOXY2OXOETHYL)1AZONIABICYCLO(222)OCTANE
(3S)3(BENZOYLOXY)1(2ETHOXY2OXOETHYL)1AZONIABICYCLO(222)OCTANE
1(2ethoxy2oxoethyl)3((phenylcarbonyl)oxy)1azoniabicyclo(222)octane
CCOC(=O)C(N@+)12CC(C@H)(CC1)C(C2)OC(=O)c1ccccc1(Br)
CCOC(=O)C(N+)12CCC(CC1)C(C2)OC(=O)c1ccccc1
CCOC(=O)C(N+)12CCC(CC1)C(C2)OC(=O)C3=CC=CC=C3
InChI=1SC18H24NO4c122217(20)131910814(91119)16(1219)2318(21)156435715h371416H2813H21H3q+1
MFCD03009792
ZINC000001831874
ZINC000001831875
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