Vitas-M small molecule compound
(2E)-2-(4-bromophenyl)-3-{4-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Catalog ID
STK292889
SMILES N#C/C(=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])/c1ccc(cc1)Br
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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 C22H15BrN2O3 MW 435.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrN2O3/c23-20-7-5-18(6-8-20)19(14-24)13-16-3-11-22(12-4-16)28-15-17-1-9-21(10-2-17)25(26)27/h1-13H,15H2/b19-13-InChIKey
NNANSLFOJMLCCD-UYRXBGFRSA-NSynonyms
(2E)2(4BROMOPHENYL)3(4((4NITROBENZYL)OXY)PHENYL)PROP2ENENITRILE
(E)2(4BROMOPHENYL)3(4((4NITROPHENYL)METHOXY)PHENYL)PROP2ENENITRILE
C1=CC(=CC=C1COC2=CC=C(C=C2)C=C(C#N)C3=CC=C(C=C3)Br)(N+)(=O)(O)
InChI=1SC22H15BrN2O3c23207518(6820)19(1424)131631122(12416)2815171921(10217)25(26)27h113H15H2b1913
MFCD06627081
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1)(N+)(=O)(O))c1ccc(cc1)Br
ZINC000002877829
ZINC02877829
ZINC2877829
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