Vitas-M small molecule compound
4,8-diethoxy-1,3-dimethyl-2-(tetrahydrofuran-2-ylmethyl)cyclohepta[c]pyrrolium perchlorate
Catalog ID
STK035434
SMILES [O-][Cl](=O)(=O)=O.CCOc1cccc(c2c1c(C)[n+](c2C)CC1CCCO1)OCC
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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 C20H28ClNO7 MW 429.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28NO3.ClHO4/c1-5-22-17-10-7-11-18(23-6-2)20-15(4)21(14(3)19(17)20)13-16-9-8-12-24-16;2-1(3,4)5/h7,10-11,16H,5-6,8-9,12-13H2,1-4H3;(H,2,3,4,5)/q+1;/p-1InChIKey
GAUGGMKZPAVUHN-UHFFFAOYSA-MSynonyms
(O)(Cl)(=O)(=O)=OCCOc1cccc(c2c1c(C)(n+)(c2C)CC1CCCO1)OCC
48diethoxy13dimethyl2((tetrahydrofuran2yl)methyl)cyclohepta(c)pyrrol2iumperchlorate
48diethoxy13dimethyl2(oxolan2ylmethyl)cyclohepta(c)pyrrol2iumperchlorate
48DIETHOXY13DIMETHYL2(TETRAHYDROFURAN2YLMETHYL)CYCLOHEPTA(C)PYRROLIUM
48DIETHOXY13DIMETHYL2(TETRAHYDROFURAN2YLMETHYL)CYCLOHEPTA(C)PYRROLIUMPERCHLORATE
CCOC1=C2C(=(N+)(C(=C2C(=CC=C1)OCC)C)CC3CCCO3)C(O)Cl(=O)(=O)=O
InChI=1SC20H28NO3ClHO4c1522171071118(2362)2015(4)21(14(3)19(17)20)13169812241621(34)5h7101116H56891213H214H3(H2345)q+1p1
MFCD03793500
STK035434
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