Vitas-M small molecule compound
2-[(2-bromobenzyl)amino]-2-oxoethyl 1,3-benzodioxole-5-carboxylate
Catalog ID
STL099673
SMILES O=C(NCc1ccccc1Br)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 C17H14BrNO5 MW 392.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrNO5/c18-13-4-2-1-3-12(13)8-19-16(20)9-22-17(21)11-5-6-14-15(7-11)24-10-23-14/h1-7H,8-10H2,(H,19,20)InChIKey
YXBUEZBMIAFGLO-UHFFFAOYSA-NSynonyms
(2((2bromophenyl)methylamino)2oxoethyl)13benzodioxole5carboxylate
2((2bromobenzyl)amino)2oxoethyl13benzodioxole5carboxylate
C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NCC3=CC=CC=C3Br
InChI=1SC17H14BrNO5c1813421312(13)81916(20)92217(21)11561415(711)24102314h17H810H2(H1920)
MFCD18790348
ZINC000067197519
ZINC67197519
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