Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-2-oxoethyl (2E)-3-(5-nitrofuran-2-yl)prop-2-enoate
Catalog ID
STK766631
SMILES O=C(OCC(=O)c1ccc(c(c1)C)C)/C=C/c1ccc(o1)[N+](=O)[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 C17H15NO6 MW 329.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO6/c1-11-3-4-13(9-12(11)2)15(19)10-23-17(20)8-6-14-5-7-16(24-14)18(21)22/h3-9H,10H2,1-2H3/b8-6+InChIKey
GLTPPVNYZGTSSB-SOFGYWHQSA-NSynonyms
461671-81-8(2(34DIMETHYLPHENYL)2OXOETHYL)(E)3(5NITROFURAN2YL)PROP2ENOATE
2(34DIMETHYLPHENYL)2OXOETHYL(2E)3(5NITRO2FURYL)2PROPENOATE
2(34dimethylphenyl)2oxoethyl(2E)3(5nitrofuran2yl)prop2enoate
2(34DIMETHYLPHENYL)2OXOETHYL3(5NITRO2FURYL)ACRYLATE
3(5NITROFURAN2YL)ACRYLICACID2(34DIMETHYLPHENYL)2OXOETHYLESTER
461671818
CC1=C(C=C(C=C1)C(=O)COC(=O)C=CC2=CC=C(O2)(N+)(=O)(O))C
InChI=1SC17H15NO6c1113413(912(11)2)15(19)102317(20)86145716(2414)18(21)22h39H10H212H3b86+
MFCD02944410
O=C(OCC(=O)c1ccc(c(c1)C)C)C=Cc1ccc(o1)(N+)(=O)(O)
ZINC000000091530
ZINC00091530
ZINC91530
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