Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl 3-fluoro-4-methylbenzoate
Catalog ID
STL014622
SMILES O=C(COC(=O)c1ccc(c(c1)F)C)NCc1ccc2c(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 C18H16FNO5 MW 345.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FNO5/c1-11-2-4-13(7-14(11)19)18(22)23-9-17(21)20-8-12-3-5-15-16(6-12)25-10-24-15/h2-7H,8-10H2,1H3,(H,20,21)InChIKey
XFVMUMCHJZBTFR-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5ylmethylamino)2oxoethyl)3fluoro4methylbenzoate
2((13benzodioxol5ylmethyl)amino)2oxoethyl3fluoro4methylbenzoate
CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2=CC3=C(C=C2)OCO3)F
InChI=1SC18H16FNO5c1112413(714(11)19)18(22)23917(21)20812351516(612)25102415h27H810H21H3(H2021)
MFCD18186587
ZINC000008259535
ZINC08259535
ZINC8259535
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