Vitas-M small molecule compound
2-[(3-fluoro-4-methylphenyl)amino]-2-oxoethyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate
Catalog ID
STL187784
SMILES O=C(Nc1ccc(c(c1)F)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 C18H16FNO5 MW 345.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FNO5/c1-11-6-7-12(8-13(11)19)20-17(21)10-24-18(22)16-9-23-14-4-2-3-5-15(14)25-16/h2-8,16H,9-10H2,1H3,(H,20,21)InChIKey
XAHMVZBRPAPNRQ-UHFFFAOYSA-NSynonyms
871551-90-5(2(3fluoro4methylanilino)2oxoethyl)23dihydro14benzodioxine3carboxylate
2((3fluoro4methylphenyl)amino)2oxoethyl23dihydro14benzodioxine2carboxylate
871551905
CC1=C(C=C(C=C1)NC(=O)COC(=O)C2COC3=CC=CC=C3O2)F
InChI=1SC18H16FNO5c1116712(813(11)19)2017(21)102418(22)1692314423515(14)2516h2816H910H21H3(H2021)
MFCD07349628
ZINC000003497433
ZINC000003497435
ZINC03497433
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