Vitas-M small molecule compound

2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl 1,3-benzodioxole-5-carboxylate

Catalog ID
STL100241
SMILES O=C(Nc1ccc2c(c1)OCO2)COC(=O)c1ccc2c(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 C17H13NO7 MW 343.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO7/c19-16(18-11-2-4-13-15(6-11)25-9-23-13)7-21-17(20)10-1-3-12-14(5-10)24-8-22-12/h1-6H,7-9H2,(H,18,19)
InChIKey
OQIWTVXSTLDOBA-UHFFFAOYSA-N
Synonyms
386260-97-5
(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)13BENZODIOXOLE5CARBOXYLATE
2(13benzodioxol5ylamino)2oxoethyl13benzodioxole5carboxylate
386260975
C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC17H13NO7c1916(1811241315(611)2592313)72117(20)10131214(510)2482212h16H79H2(H1819)
MFCD03480374
ZINC000003239778
ZINC03239778
ZINC3239778

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.