Vitas-M small molecule compound
2-(cyclohexylamino)-2-oxoethyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
Catalog ID
STL187757
SMILES O=C(NC1CCCCC1)COC(=O)C1COc2c(O1)cccc2
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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 C17H21NO5 MW 319.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO5/c19-16(18-12-6-2-1-3-7-12)11-22-17(20)15-10-21-13-8-4-5-9-14(13)23-15/h4-5,8-9,12,15H,1-3,6-7,10-11H2,(H,18,19)InChIKey
QSDPULSOUKCTFW-UHFFFAOYSA-NSynonyms
742118-19-0(2(CYCLOHEXYLAMINO)2OXOETHYL)23DIHYDRO14BENZODIOXINE3CARBOXYLATE
2(cyclohexylamino)2oxoethyl23dihydro14benzodioxine2carboxylate
742118190
C1CCC(CC1)NC(=O)COC(=O)C2COC3=CC=CC=C3O2
InChI=1SC17H21NO5c1916(18126213712)112217(20)15102113845914(13)2315h45891215H13671011H2(H1819)
MFCD05261825
ZINC000003315406
ZINC000003315408
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