Vitas-M small molecule compound
2-(4-nitrophenyl)-2-oxoethyl (2E)-2-(acetylamino)-3-(1,3-benzodioxol-5-yl)prop-2-enoate
Catalog ID
STK526703
SMILES CC(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)OCC(=O)c1ccc(cc1)[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 C20H16N2O8 MW 412.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O8/c1-12(23)21-16(8-13-2-7-18-19(9-13)30-11-29-18)20(25)28-10-17(24)14-3-5-15(6-4-14)22(26)27/h2-9H,10-11H2,1H3,(H,21,23)/b16-8+InChIKey
MGQTZMINWGBHIB-LZYBPNLTSA-NSynonyms
302799-04-8(2(4NITROPHENYL)2OXOETHYL)(E)2ACETAMIDO3(13BENZODIOXOL5YL)PROP2ENOATE
(E)2(4nitrophenyl)2oxoethyl2acetamido3(benzo(d)(13)dioxol5yl)acrylate
2(4nitrophenyl)2oxoethyl(2E)2(acetylamino)3(13benzodioxol5yl)prop2enoate
302799048
CC(=O)NC(=CC1=CC2=C(C=C1)OCO2)C(=O)OCC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CC(=O)NC(=Cc1ccc2c(c1)OCO2)C(=O)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H16N2O8c112(23)2116(813271819(913)30112918)20(25)281017(24)143515(6414)22(26)27h29H1011H21H3(H2123)b168+
MFCD00613333
ZINC000001757109
ZINC01757109
ZINC1757109
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