Vitas-M small molecule compound
(2E)-2-cyano-3-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]-N-(4-hydroxyphenyl)prop-2-enamide
Catalog ID
STK124553
SMILES N#C/C(=C\c1ccc(c(c1)OC)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C(=O)Nc1ccc(cc1)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 C23H16N4O8 MW 476.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O8/c1-34-22-11-14(10-15(13-24)23(29)25-16-3-6-18(28)7-4-16)2-8-21(22)35-20-9-5-17(26(30)31)12-19(20)27(32)33/h2-12,28H,1H3,(H,25,29)/b15-10+InChIKey
IBKHKDAFCZDMFV-XNTDXEJSSA-NSynonyms
(2E)2CYANO3(4(24DINITROPHENOXY)3METHOXYPHENYL)N(4HYDROXYPHENYL)PROP2ENAMIDE
(E)2CYANO3(4(24DINITROPHENOXY)3METHOXYPHENYL)N(4HYDROXYPHENYL)PROP2ENAMIDE
COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)O)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC23H16N4O8c134221114(1015(1324)23(29)25163618(28)7416)2821(22)35209517(26(30)31)1219(20)27(32)33h21228H1H3(H2529)b1510+
MFCD06662603
N#CC(=Cc1ccc(c(c1)OC)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)Nc1ccc(cc1)O
ZINC000009833635
ZINC09833635
ZINC9833635
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