Vitas-M small molecule compound
(2E)-2-(acetylamino)-3-(1,3-benzodioxol-5-yl)prop-2-enoic acid
Catalog ID
STL558391
SMILES CC(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=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 C12H11NO5 MW 249.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11NO5/c1-7(14)13-9(12(15)16)4-8-2-3-10-11(5-8)18-6-17-10/h2-5H,6H2,1H3,(H,13,14)(H,15,16)/b9-4+InChIKey
QTNHDDAPMUJZSZ-RUDMXATFSA-NSynonyms
66789-45-5(~(E))2acetamido3(13benzodioxol5yl)prop2enoicacid
(2E)2(acetylamino)3(13benzodioxol5yl)prop2enoicacid
(2E)3(2HBENZO(34D)13DIOXOLAN5YL)2(ACETYLAMINO)PROP2ENOICACID
(E)2ACETAMIDO3(13BENZODIOXOL5YL)PROP2ENOICACID
(E)2acetamido3(benzo(d)(13)dioxol5yl)acrylicacid
1755800
2ACETYLAMINO3BENZO(13)DIOXOL5YLACRYLICACID
66789455
CC(=O)NC(=Cc1ccc2c(c1)OCO2)C(=O)O
InChI=1SC12H11NO5c17(14)139(12(15)16)48231011(58)1861710h25H6H21H3(H1314)(H1516)b94+
MFCD00699020
ZINC000000128304
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