Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl 2-bromobenzoate
Catalog ID
STL186376
SMILES O=C(Nc1ccc2c(c1)OCO2)COC(=O)c1ccccc1Br
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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 C16H12BrNO5 MW 378.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrNO5/c17-12-4-2-1-3-11(12)16(20)21-8-15(19)18-10-5-6-13-14(7-10)23-9-22-13/h1-7H,8-9H2,(H,18,19)InChIKey
CBNBETMRNASHFD-UHFFFAOYSA-NSynonyms
387380-33-8(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)2BROMOBENZOATE
2(13benzodioxol5ylamino)2oxoethyl2bromobenzoate
387380338
C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=CC=CC=C3Br
InChI=1SC16H12BrNO5c1712421311(12)16(20)21815(19)1810561314(710)2392213h17H89H2(H1819)
MFCD04503911
ZINC000003506973
ZINC03506973
ZINC3506973
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