Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl 2-chloro-5-fluorobenzoate
Catalog ID
STL186797
SMILES O=C(Nc1ccc2c(c1)OCO2)COC(=O)c1cc(F)ccc1Cl
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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 C16H11ClFNO5 MW 351.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClFNO5/c17-12-3-1-9(18)5-11(12)16(21)22-7-15(20)19-10-2-4-13-14(6-10)24-8-23-13/h1-6H,7-8H2,(H,19,20)InChIKey
XKZFRSRDLCRXQF-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5ylamino)2oxoethyl)2chloro5fluorobenzoate
2(13benzodioxol5ylamino)2oxoethyl2chloro5fluorobenzoate
C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)F)Cl
InChI=1SC16H11ClFNO5c1712319(18)511(12)16(21)22715(20)1910241314(610)2482313h16H78H2(H1920)
MFCD22387888
ZINC000072330148
ZINC72330148
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