Vitas-M small molecule compound
(3E)-3-(3-iodo-4-methoxy-5-nitrobenzylidene)-5-phenylfuran-2(3H)-one
Catalog ID
STK196813
SMILES COc1c(I)cc(cc1[N+](=O)[O-])/C=C/1\C=C(OC1=O)c1ccccc1
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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 C18H12INO5 MW 449.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12INO5/c1-24-17-14(19)8-11(9-15(17)20(22)23)7-13-10-16(25-18(13)21)12-5-3-2-4-6-12/h2-10H,1H3/b13-7+InChIKey
SIGDADFEUGXTIS-NTUHNPAUSA-NSynonyms
(3E)3((3IODO4METHOXY5NITROPHENYL)METHYLIDENE)5PHENYLFURAN2ONE
(3E)3(3IODO4METHOXY5NITROBENZYLIDENE)5PHENYLFURAN2(3H)ONE
3((5IODO4METHOXY3NITROPHENYL)METHYLENE)5PHENYLFURAN2ONE
3(3IODO4METHOXY5NITROBENZYLIDENE)5PHENYL3HFURAN2ONE
COC1=C(C=C(C=C1I)C=C2C=C(OC2=O)C3=CC=CC=C3)(N+)(=O)(O)
COc1c(I)cc(cc1(N+)(=O)(O))C=C1C=C(OC1=O)c1ccccc1
InChI=1SC18H12INO5c1241714(19)811(915(17)20(22)23)7131016(2518(13)21)125324612h210H1H3b137+
MFCD01053153
ZINC000000832386
ZINC00832386
ZINC832386
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