Vitas-M small molecule compound
(2E)-2-(1,3-benzodioxol-5-yl)-3-{2-[(4-nitrobenzyl)oxy]phenyl}prop-2-enenitrile
Catalog ID
STK293053
SMILES N#C/C(=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])/c1ccc2c(c1)OCO2
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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 C23H16N2O5 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O5/c24-13-19(17-7-10-22-23(12-17)30-15-29-22)11-18-3-1-2-4-21(18)28-14-16-5-8-20(9-6-16)25(26)27/h1-12H,14-15H2/b19-11-InChIKey
GZJBDRWSYPCUSX-ODLFYWEKSA-NSynonyms
(2E)2(13BENZODIOXOL5YL)3(2((4NITROBENZYL)OXY)PHENYL)PROP2ENENITRILE
(E)2(13BENZODIOXOL5YL)3(2((4NITROPHENYL)METHOXY)PHENYL)PROP2ENENITRILE
C1OC2=C(O1)C=C(C=C2)C(=CC3=CC=CC=C3OCC4=CC=C(C=C4)(N+)(=O)(O))C#N
InChI=1SC23H16N2O5c241319(177102223(1217)30152922)1118312421(18)2814165820(9616)25(26)27h112H1415H2b1911
MFCD05824405
N#CC(=Cc1ccccc1OCc1ccc(cc1)(N+)(=O)(O))c1ccc2c(c1)OCO2
ZINC000016361736
ZINC16361736
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