Vitas-M small molecule compound
4-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]phenyl 4-methylbenzoate
Catalog ID
STL420149
SMILES CCOC(=O)/C(=C/c1ccc(cc1)OC(=O)c1ccc(cc1)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 C20H17NO4 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO4/c1-3-24-19(22)17(13-21)12-15-6-10-18(11-7-15)25-20(23)16-8-4-14(2)5-9-16/h4-12H,3H2,1-2H3/b17-12+InChIKey
VMVMSTWQFWOJQV-SFQUDFHCSA-NSynonyms
(4((E)2CYANO3ETHOXY3OXOPROP1ENYL)PHENYL)4METHYLBENZOATE
4((1E)2cyano3ethoxy3oxoprop1en1yl)phenyl4methylbenzoate
CCOC(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C)C#N
CCOC(=O)C(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)C)C#N
ETHYL(2E)2CYANO3(4(4METHYLPHENYLCARBONYLOXY)PHENYL)PROP2ENOATE
InChI=1SC20H17NO4c132419(22)17(1321)121561018(11715)2520(23)168414(2)5916h412H3H212H3b1712+
MFCD02940697
ZINC000000075011
ZINC00075011
ZINC75011
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