Vitas-M small molecule compound
2-[(4-methylphenyl)amino]-2-oxoethyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
Catalog ID
STL187763
SMILES O=C(Nc1ccc(cc1)C)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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c1-12-6-8-13(9-7-12)19-17(20)11-23-18(21)16-10-22-14-4-2-3-5-15(14)24-16/h2-9,16H,10-11H2,1H3,(H,19,20)InChIKey
JCRTYUCNNDUUBG-UHFFFAOYSA-NSynonyms
848323-01-3(2(4METHYLANILINO)2OXOETHYL)23DIHYDRO14BENZODIOXINE3CARBOXYLATE
2((4methylphenyl)amino)2oxoethyl23dihydro14benzodioxine2carboxylate
848323013
CC1=CC=C(C=C1)NC(=O)COC(=O)C2COC3=CC=CC=C3O2
InChI=1SC18H17NO5c1126813(9712)1917(20)112318(21)16102214423515(14)2416h2916H1011H21H3(H1920)
MFCD05318130
ZINC000003497739
ZINC000006942888
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