Vitas-M small molecule compound
(2E)-3-[5-bromo-2-(prop-2-yn-1-yloxy)phenyl]-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STL384152
SMILES C#CCOc1ccc(cc1/C=C(\c1ccc(cc1)[N+](=O)[O-])/C#N)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 C18H11BrN2O3 MW 383.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11BrN2O3/c1-2-9-24-18-8-5-16(19)11-14(18)10-15(12-20)13-3-6-17(7-4-13)21(22)23/h1,3-8,10-11H,9H2/b15-10-InChIKey
JIKQRRZUJJDZIU-GDNBJRDFSA-NSynonyms
(2E)3(5bromo2(prop2yn1yloxy)phenyl)2(4nitrophenyl)prop2enenitrile
(E)3(5BROMO2PROP2YNOXYPHENYL)2(4NITROPHENYL)PROP2ENENITRILE
C#CCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=CC=C(C=C2)(N+)(=O)(O)
C#CCOc1ccc(cc1C=C(c1ccc(cc1)(N+)(=O)(O))C#N)Br
InChI=1SC18H11BrN2O3c12924188516(19)1114(18)1015(1220)133617(7413)21(22)23h1381011H9H2b1510
MFCD05989385
ZINC000012342717
ZINC12342717
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