Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}-3-methoxyphenyl)prop-2-enoate
Catalog ID
STK153960
SMILES CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)/C=C(/C(=O)OCC)\C#N
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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 C27H33NO6 MW 467.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO6/c1-4-6-7-8-15-32-23-10-12-24(13-11-23)33-16-17-34-25-14-9-21(19-26(25)30-3)18-22(20-28)27(29)31-5-2/h9-14,18-19H,4-8,15-17H2,1-3H3/b22-18+InChIKey
CJELKVNYVHUYCM-RELWKKBWSA-NSynonyms
CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C(C#N)C(=O)OCC)OC
CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OC)C=C(C(=O)OCC)C#N
ETHYL(2E)2CYANO3(4(2(4(HEXYLOXY)PHENOXY)ETHOXY)3METHOXYPHENYL)PROP2ENOATE
ethyl(E)2cyano3(4(2(4hexoxyphenoxy)ethoxy)3methoxyphenyl)prop2enoate
InChI=1SC27H33NO6c14678153223101224(131123)331617342514921(1926(25)303)1822(2028)27(29)3152h9141819H481517H213H3b2218+
MFCD08673011
ZINC000013881207
ZINC13881207
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