Vitas-M small molecule compound
(2Z)-3-{3-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STK392767
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCCOc1ccc(cc1)C)/c1ccc(cc1)[N+](=O)[O-]
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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 C25H22N2O5 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5/c1-18-3-10-23(11-4-18)31-13-14-32-24-12-5-19(16-25(24)30-2)15-21(17-26)20-6-8-22(9-7-20)27(28)29/h3-12,15-16H,13-14H2,1-2H3/b21-15+InChIKey
XQKCEBCIQLKLLB-RCCKNPSSSA-NSynonyms
(2Z)3(3methoxy4(2(4methylphenoxy)ethoxy)phenyl)2(4nitrophenyl)prop2enenitrile
(Z)3(3METHOXY4(2(4METHYLPHENOXY)ETHOXY)PHENYL)2(4NITROPHENYL)PROP2ENENITRILE
CC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C(C#N)C3=CC=C(C=C3)(N+)(=O)(O))OC
InChI=1SC25H22N2O5c11831023(11418)311314322412519(1625(24)302)1521(1726)206822(9720)27(28)29h3121516H1314H212H3b2115+
MFCD02914379
N#CC(=Cc1ccc(c(c1)OC)OCCOc1ccc(cc1)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000004182071
ZINC04182071
ZINC4182071
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