Vitas-M small molecule compound
2-{2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}benzoic acid
Catalog ID
STL245917
SMILES O=C(Cc1ccccc1C(=O)O)Nc1cc2OCOc2cc1C(=O)C
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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 C18H15NO6 MW 341.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO6/c1-10(20)13-7-15-16(25-9-24-15)8-14(13)19-17(21)6-11-4-2-3-5-12(11)18(22)23/h2-5,7-8H,6,9H2,1H3,(H,19,21)(H,22,23)InChIKey
XIESYQQRNFCPCT-UHFFFAOYSA-NSynonyms
1324066-28-51324066285
2(2((6acetyl13benzodioxol5yl)amino)2oxoethyl)benzoicacid
2(2((6acetylbenzo(d)(13)dioxol5yl)amino)2oxoethyl)benzoicacid
CC(=O)C1=CC2=C(C=C1NC(=O)CC3=CC=CC=C3C(=O)O)OCO2
InChI=1SC18H15NO6c110(20)1371516(2592415)814(13)1917(21)611423512(11)18(22)23h2578H69H21H3(H1921)(H2223)
MFCD19711072
ZINC000071284453
ZINC71284453
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