Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl 4-(acetylamino)benzoate
Catalog ID
STL100022
SMILES O=C(Nc1ccc2c(c1)OCO2)COC(=O)c1ccc(cc1)NC(=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 C18H16N2O6 MW 356.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O6/c1-11(21)19-13-4-2-12(3-5-13)18(23)24-9-17(22)20-14-6-7-15-16(8-14)26-10-25-15/h2-8H,9-10H2,1H3,(H,19,21)(H,20,22)InChIKey
XKQQSDSARFBBCE-UHFFFAOYSA-NSynonyms
389811-74-9(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)4ACETAMIDOBENZOATE
2(13benzodioxol5ylamino)2oxoethyl4(acetylamino)benzoate
389811749
CC(=O)NC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCO3
InChI=1SC18H16N2O6c111(21)19134212(3513)18(23)24917(22)2014671516(814)26102515h28H910H21H3(H1921)(H2022)
MFCD03961889
ZINC000003262159
ZINC03262159
ZINC3262159
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