Vitas-M small molecule compound
ethyl (2E)-3-(3-butoxyphenyl)-2-cyanoprop-2-enoate
Catalog ID
STK422702
SMILES CCCCOc1cccc(c1)/C=C(/C(=O)OCC)\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 C16H19NO3 MW 273.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO3/c1-3-5-9-20-15-8-6-7-13(11-15)10-14(12-17)16(18)19-4-2/h6-8,10-11H,3-5,9H2,1-2H3/b14-10+InChIKey
RSOBEOFGUXMAQQ-GXDHUFHOSA-NSynonyms
CCCCOC1=CC=CC(=C1)C=C(C#N)C(=O)OCC
CCCCOc1cccc(c1)C=C(C(=O)OCC)C#N
ethyl(2E)3(3butoxyphenyl)2cyanoprop2enoate
ETHYL(E)3(3BUTOXYPHENYL)2CYANOPROP2ENOATE
InChI=1SC16H19NO3c1359201586713(1115)1014(1217)16(18)1942h681011H359H212H3b1410+
MFCD02177084
ZINC000002768108
ZINC02768108
ZINC2768108
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