Vitas-M small molecule compound
methyl (2E)-2-cyano-3-(3-ethoxy-4-propoxyphenyl)prop-2-enoate
Catalog ID
STK422709
SMILES CCCOc1ccc(cc1OCC)/C=C(/C(=O)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 C16H19NO4 MW 289.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO4/c1-4-8-21-14-7-6-12(10-15(14)20-5-2)9-13(11-17)16(18)19-3/h6-7,9-10H,4-5,8H2,1-3H3/b13-9+InChIKey
KXIMUFLYAIYQGE-UKTHLTGXSA-NSynonyms
CCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)OC)OCC
CCCOc1ccc(cc1OCC)C=C(C(=O)OC)C#N
InChI=1SC16H19NO4c14821147612(1015(14)2052)913(1117)16(18)193h67910H458H213H3b139+
methyl(2E)2cyano3(3ethoxy4propoxyphenyl)prop2enoate
METHYL(E)2CYANO3(3ETHOXY4PROPOXYPHENYL)PROP2ENOATE
MFCD02177113
ZINC000002768555
ZINC02768555
ZINC2768555
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