Vitas-M small molecule compound
2-{[1-(4-methylphenyl)ethyl]amino}-2-oxoethyl 4-fluorobenzoate
Catalog ID
STL099638
SMILES O=C(NC(c1ccc(cc1)C)C)COC(=O)c1ccc(cc1)F
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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 C18H18FNO3 MW 315.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FNO3/c1-12-3-5-14(6-4-12)13(2)20-17(21)11-23-18(22)15-7-9-16(19)10-8-15/h3-10,13H,11H2,1-2H3,(H,20,21)InChIKey
MRBRFMHZLVLGTM-UHFFFAOYSA-NSynonyms
(2(1(4methylphenyl)ethylamino)2oxoethyl)4fluorobenzoate
2((1(4methylphenyl)ethyl)amino)2oxoethyl4fluorobenzoate
CC1=CC=C(C=C1)C(C)NC(=O)COC(=O)C2=CC=C(C=C2)F
InChI=1SC18H18FNO3c1123514(6412)13(2)2017(21)112318(22)157916(19)10815h31013H11H212H3(H2021)
MFCD18790326
ZINC000067197457
ZINC000067197458
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