Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-{3-methoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}prop-2-enoate
Catalog ID
STK060691
SMILES CCOC(=O)/C(=C/c1ccc(c(c1)OC)OCCOc1cccc(c1)C)/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 C22H23NO5 MW 381.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5/c1-4-26-22(24)18(15-23)13-17-8-9-20(21(14-17)25-3)28-11-10-27-19-7-5-6-16(2)12-19/h5-9,12-14H,4,10-11H2,1-3H3/b18-13+InChIKey
UGRQTQRGYLYOBO-QGOAFFKASA-NSynonyms
CCOC(=O)C(=CC1=CC(=C(C=C1)OCCOC2=CC=CC(=C2)C)OC)C#N
CCOC(=O)C(=Cc1ccc(c(c1)OC)OCCOc1cccc(c1)C)C#N
ETHYL(2E)2CYANO3(3METHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)PROP2ENOATE
ETHYL(E)2CYANO3(3METHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)PROP2ENOATE
InChI=1SC22H23NO5c142622(24)18(1523)13178920(21(1417)253)281110271975616(2)1219h591214H41011H213H3b1813+
MFCD02125251
STK060691
ZINC000009553505
ZINC09553505
ZINC9553505
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