Vitas-M small molecule compound
4-[(1Z)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]phenyl 4-methoxybenzoate
Catalog ID
STL428738
SMILES CCOC(=O)/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)OC)/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 C20H17NO5 MW 351.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5/c1-3-25-19(22)16(13-21)12-14-4-8-18(9-5-14)26-20(23)15-6-10-17(24-2)11-7-15/h4-12H,3H2,1-2H3/b16-12-InChIKey
HAKHZZRKQRDJRD-VBKFSLOCSA-NSynonyms
(4((Z)2CYANO3ETHOXY3OXOPROP1ENYL)PHENYL)4METHOXYBENZOATE
4((1Z)2cyano3ethoxy3oxoprop1en1yl)phenyl4methoxybenzoate
CCOC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC)C#N
CCOC(=O)C(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)OC)C#N
InChI=1SC20H17NO5c132519(22)16(1321)12144818(9514)2620(23)1561017(242)11715h412H3H212H3b1612
MFCD02193113
ZINC000033667957
ZINC33667957
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