Vitas-M small molecule compound
2-[(2,5-dimethylphenyl)amino]-2-oxoethyl 4-(trifluoromethyl)benzoate
Catalog ID
STL186669
SMILES O=C(Nc1cc(C)ccc1C)COC(=O)c1ccc(cc1)C(F)(F)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 C18H16F3NO3 MW 351.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3NO3/c1-11-3-4-12(2)15(9-11)22-16(23)10-25-17(24)13-5-7-14(8-6-13)18(19,20)21/h3-9H,10H2,1-2H3,(H,22,23)InChIKey
DEMZVIYKGMGJQW-UHFFFAOYSA-NSynonyms
(2(25DIMETHYLANILINO)2OXOETHYL)4(TRIFLUOROMETHYL)BENZOATE
2((25dimethylphenyl)amino)2oxoethyl4(trifluoromethyl)benzoate
CC1=CC(=C(C=C1)C)NC(=O)COC(=O)C2=CC=C(C=C2)C(F)(F)F
InChI=1SC18H16F3NO3c1113412(2)15(911)2216(23)102517(24)135714(8613)18(1920)21h39H10H212H3(H2223)
MFCD22387797
ZINC000005111718
ZINC5111718
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