Vitas-M small molecule compound
2-{(E)-2-[4-(acetyloxy)-3-methoxyphenyl]ethenyl}-1-ethylquinolinium
Catalog ID
STK723316
SMILES COc1cc(/C=C/c2ccc3c([n+]2CC)cccc3)ccc1OC(=O)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 C22H22NO3 MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22NO3/c1-4-23-19(13-11-18-7-5-6-8-20(18)23)12-9-17-10-14-21(26-16(2)24)22(15-17)25-3/h5-15H,4H2,1-3H3/q+1/b12-9+InChIKey
DAIZHFWOUIAZCB-FMIVXFBMSA-NSynonyms
(4((E)2(1ETHYLQUINOLIN1IUM2YL)ETHENYL)2METHOXYPHENYL)ACETATE
(E)2(4acetoxy3methoxystyryl)1ethylquinolin1iumiodide
2((E)2(4(acetyloxy)3methoxyphenyl)ethenyl)1ethylquinolinium
4((1E)2(1ETHYL(2QUINOLYL))VINYL)2METHOXYPHENYLACETATE
CC(N+)1=C(C=CC2=CC=CC=C21)C=CC3=CC(=C(C=C3)OC(=O)C)OC
COc1cc(C=Cc2ccc3c((n+)2CC)cccc3)ccc1OC(=O)C
COc1cc(C=Cc2ccc3c((n+)2CC)cccc3)ccc1OC(=O)C(I)
InChI=1SC22H22NO3c142319(131118756820(18)23)12917101421(2616(2)24)22(1517)253h515H4H213H3q+1b129+
MFCD02223901
ZINC000004937197
ZINC04937197
ZINC4937197
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