Vitas-M small molecule compound
1-(2-ethoxy-2-oxoethyl)-3-(thiophen-2-ylcarbonyl)-1-azoniabicyclo[2.2.2]octane
Catalog ID
STK862444
SMILES CCOC(=O)C[N+]12CCC(CC1)C(C2)C(=O)c1cccs1
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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 C16H22NO3S MW 308.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22NO3S/c1-2-20-15(18)11-17-7-5-12(6-8-17)13(10-17)16(19)14-4-3-9-21-14/h3-4,9,12-13H,2,5-8,10-11H2,1H3/q+1InChIKey
CIUDKPIIMNGTPO-UHFFFAOYSA-NSynonyms
(3S)1(2ETHOXY2OXOETHYL)3(THIOPHEN2YLCARBONYL)1AZONIABICYCLO(222)OCTANE
1(2ethoxy2oxoethyl)3(thiophen2ylcarbonyl)1azoniabicyclo(222)octane
1(2ethoxy2oxoethyl)3(thiophene2carbonyl)quinuclidin1iumbromide
1ETHOXYCARBONYLMETHYL3(THIOPHENE2CARBONYL)1AZONIABICYCLO(222)OCTANE
CCOC(=O)C(N+)12CCC(CC1)C(C2)C(=O)c1cccs1
CCOC(=O)C(N+)12CCC(CC1)C(C2)C(=O)c1cccs1(Br)
CCOC(=O)C(N+)12CCC(CC1)C(C2)C(=O)C3=CC=CS3
ETHYL2(3(2THIENYLCARBONYL)QUINUCLIDINYL)ACETATE
ETHYL2(3(THIOPHENE2CARBONYL)1AZONIABICYCLO(222)OCTAN1YL)ACETATE
InChI=1SC16H22NO3Sc122015(18)11177512(6817)13(1017)16(19)144392114h3491213H2581011H21H3q+1
ZINC000001756486
ZINC000001756488
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