Vitas-M small molecule compound
methyl (2E)-3-{3-bromo-4-[(4-fluorobenzyl)oxy]phenyl}-2-cyanoprop-2-enoate
Catalog ID
STL416027
SMILES N#C/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1)F)/C(=O)OC
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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 C18H13BrFNO3 MW 390.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrFNO3/c1-23-18(22)14(10-21)8-13-4-7-17(16(19)9-13)24-11-12-2-5-15(20)6-3-12/h2-9H,11H2,1H3/b14-8+InChIKey
LFQWWEKAMLWMBB-RIYZIHGNSA-NSynonyms
COC(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)F)Br)C#N
InChI=1SC18H13BrFNO3c12318(22)14(1021)8134717(16(19)913)2411122515(20)6312h29H11H21H3b148+
methyl(2E)3(3bromo4((4fluorobenzyl)oxy)phenyl)2cyanoprop2enoate
methyl(E)3(3bromo4((4fluorophenyl)methoxy)phenyl)2cyanoprop2enoate
MFCD30706923
N#CC(=Cc1ccc(c(c1)Br)OCc1ccc(cc1)F)C(=O)OC
ZINC000220956797
ZINC220956797
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