Vitas-M small molecule compound
(2E)-2-cyano-3-[4-(2,4-dinitrophenoxy)-3-iodo-5-methoxyphenyl]prop-2-enamide
Catalog ID
STL367450
SMILES N#C/C(=C\c1cc(I)c(c(c1)OC)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C(=O)N
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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 C17H11IN4O7 MW 510.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11IN4O7/c1-28-15-6-9(4-10(8-19)17(20)23)5-12(18)16(15)29-14-3-2-11(21(24)25)7-13(14)22(26)27/h2-7H,1H3,(H2,20,23)/b10-4+InChIKey
VAPHGVJAVUFTGU-ONNFQVAWSA-NSynonyms
(2E)2cyano3(4(24dinitrophenoxy)3iodo5methoxyphenyl)prop2enamide
(E)2cyano3(4(24dinitrophenoxy)3iodo5methoxyphenyl)prop2enamide
COC1=C(C(=CC(=C1)C=C(C#N)C(=O)N)I)OC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H11IN4O7c1281569(410(819)17(20)23)512(18)16(15)29143211(21(24)25)713(14)22(26)27h27H1H3(H22023)b104+
MFCD02276539
N#CC(=Cc1cc(I)c(c(c1)OC)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)N
ZINC000098086274
ZINC98086274
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