Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(2-nitrophenyl)prop-2-enamide
Catalog ID
STK108697
SMILES O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1ccc2c(c1)OCO2
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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 C17H14N2O5 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O5/c20-17(8-6-13-3-1-2-4-14(13)19(21)22)18-10-12-5-7-15-16(9-12)24-11-23-15/h1-9H,10-11H2,(H,18,20)/b8-6+InChIKey
NZFOXGFNFBKIAQ-SOFGYWHQSA-NSynonyms
600123-88-4(2E)N(13BENZODIOXOL5YLMETHYL)3(2NITROPHENYL)PROP2ENAMIDE
(2E)N(2HBENZO(34D)13DIOXOLEN5YLMETHYL)3(2NITROPHENYL)PROP2ENAMIDE
(E)N(13BENZODIOXOL5YLMETHYL)3(2NITROPHENYL)PROP2ENAMIDE
600123884
C1OC2=C(O1)C=C(C=C2)CNC(=O)C=CC3=CC=CC=C3(N+)(=O)(O)
InChI=1SC17H14N2O5c2017(8613312414(13)19(21)22)181012571516(912)24112315h19H1011H2(H1820)b86+
MFCD03639032
O=C(C=Cc1ccccc1(N+)(=O)(O))NCc1ccc2c(c1)OCO2
ZINC000000463503
ZINC00463503
ZINC463503
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