Vitas-M small molecule compound
ethyl (2E)-3-{3-chloro-5-methoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}-2-cyanoprop-2-enoate
Catalog ID
STK385632
SMILES CCOC(=O)/C(=C/c1cc(Cl)c(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 C22H22ClNO5 MW 415.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClNO5/c1-4-27-22(25)17(14-24)11-16-12-19(23)21(20(13-16)26-3)29-9-8-28-18-7-5-6-15(2)10-18/h5-7,10-13H,4,8-9H2,1-3H3/b17-11+InChIKey
STIIZZXXXSJXOC-GZTJUZNOSA-NSynonyms
CCOC(=O)C(=CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=CC(=C2)C)OC)C#N
CCOC(=O)C(=Cc1cc(Cl)c(c(c1)OC)OCCOc1cccc(c1)C)C#N
ETHYL(2E)3(3CHLORO5METHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)2CYANOPROP2ENOATE
ETHYL(E)3(3CHLORO5METHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)2CYANOPROP2ENOATE
InChI=1SC22H22ClNO5c142722(25)17(1424)11161219(23)21(20(1316)263)2998281875615(2)1018h571013H489H213H3b1711+
MFCD02126952
ZINC000004512516
ZINC04512516
ZINC4512516
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