Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK323268
SMILES O=C(/C=C/c1cccc(c1)[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(7-5-12-2-1-3-14(8-12)19(21)22)18-10-13-4-6-15-16(9-13)24-11-23-15/h1-9H,10-11H2,(H,18,20)/b7-5+InChIKey
XIXMIEGVHBUMEW-FNORWQNLSA-NSynonyms
1164481-28-0(2E)N(13benzodioxol5ylmethyl)3(3nitrophenyl)prop2enamide
(2E)N(2HBENZO(34D)13DIOXOLEN5YLMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(13BENZODIOXOL5YLMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
1164481280
C1OC2=C(O1)C=C(C=C2)CNC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC17H14N2O5c2017(751221314(812)19(21)22)181013461516(913)24112315h19H1011H2(H1820)b75+
MFCD01350586
N(13BENZODIOXOL5YLMETHYL)3(3NITROPHENYL)ACRYLAMIDE
O=C(C=Cc1cccc(c1)(N+)(=O)(O))NCc1ccc2c(c1)OCO2
ZINC000000456866
ZINC00456866
ZINC456866
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