Vitas-M small molecule compound
(2Z)-3-[3-ethoxy-5-iodo-4-(prop-2-en-1-yloxy)phenyl]-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STK192495
SMILES C=CCOc1c(I)cc(cc1OCC)/C=C(/c1ccc(cc1)[N+](=O)[O-])\C#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 C20H17IN2O4 MW 476.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17IN2O4/c1-3-9-27-20-18(21)11-14(12-19(20)26-4-2)10-16(13-22)15-5-7-17(8-6-15)23(24)25/h3,5-8,10-12H,1,4,9H2,2H3/b16-10+InChIKey
QBXDTBCQGADQRN-MHWRWJLKSA-NSynonyms
(2Z)3(3ETHOXY5IODO4(PROP2EN1YLOXY)PHENYL)2(4NITROPHENYL)PROP2ENENITRILE
(Z)3(3ETHOXY5IODO4PROP2ENOXYPHENYL)2(4NITROPHENYL)PROP2ENENITRILE
C=CCOc1c(I)cc(cc1OCC)C=C(c1ccc(cc1)(N+)(=O)(O))C#N
CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC=C(C=C2)(N+)(=O)(O))I)OCC=C
InChI=1SC20H17IN2O4c139272018(21)1114(1219(20)2642)1016(1322)155717(8615)23(24)25h3581012H149H22H3b1610+
MFCD05800910
ZINC000002846730
ZINC02846730
ZINC2846730
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