Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}phenyl)prop-2-enoate
Catalog ID
STK099339
SMILES CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1)/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 C26H31NO5 MW 437.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO5/c1-3-5-6-7-16-30-24-12-14-25(15-13-24)32-18-17-31-23-10-8-21(9-11-23)19-22(20-27)26(28)29-4-2/h8-15,19H,3-7,16-18H2,1-2H3/b22-19+InChIKey
WUUSVMIJBQVPIU-ZBJSNUHESA-NSynonyms
CCCCCCOC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C=C(C#N)C(=O)OCC
CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1)C=C(C(=O)OCC)C#N
ETHYL(2E)2CYANO3(4(2(4(HEXYLOXY)PHENOXY)ETHOXY)PHENYL)PROP2ENOATE
ETHYL(E)2CYANO3(4(2(4HEXOXYPHENOXY)ETHOXY)PHENYL)PROP2ENOATE
InChI=1SC26H31NO5c13567163024121425(151324)321817312310821(91123)1922(2027)26(28)2942h81519H371618H212H3b2219+
MFCD08672998
STK099339
ZINC000023017427
ZINC23017427
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