Vitas-M small molecule compound
(2E)-2-(4-chlorophenyl)-3-{2-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Catalog ID
STK201126
SMILES N#C/C(=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])/c1ccc(cc1)Cl
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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 C22H15ClN2O3 MW 390.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN2O3/c23-20-9-7-17(8-10-20)19(14-24)13-18-3-1-2-4-22(18)28-15-16-5-11-21(12-6-16)25(26)27/h1-13H,15H2/b19-13-InChIKey
YXDWCIOGUJPBPQ-UYRXBGFRSA-NSynonyms
(2E)2(4CHLOROPHENYL)3(2((4NITROBENZYL)OXY)PHENYL)PROP2ENENITRILE
(E)2(4CHLOROPHENYL)3(2((4NITROPHENYL)METHOXY)PHENYL)PROP2ENENITRILE
C1=CC=C(C(=C1)C=C(C#N)C2=CC=C(C=C2)Cl)OCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC22H15ClN2O3c23209717(81020)19(1424)1318312422(18)28151651121(12616)25(26)27h113H15H2b1913
MFCD05988054
N#CC(=Cc1ccccc1OCc1ccc(cc1)(N+)(=O)(O))c1ccc(cc1)Cl
ZINC000002849218
ZINC02849218
ZINC2849218
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