Vitas-M small molecule compound
3-(4-chlorophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl N-(tert-butoxycarbonyl)alaninate
Catalog ID
STK370634
SMILES O=C(OC(C)(C)C)NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F)C
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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 C24H21ClF3NO7 MW 527.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClF3NO7/c1-12(29-22(32)36-23(2,3)4)21(31)34-15-9-10-16-17(11-15)35-20(24(26,27)28)19(18(16)30)33-14-7-5-13(25)6-8-14/h5-12H,1-4H3,(H,29,32)InChIKey
ADFOYFITXASPRF-UHFFFAOYSA-NSynonyms
(3(4CHLOROPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PROPANOATE
3(4chlorophenoxy)4oxo2(trifluoromethyl)4Hchromen7ylN(tertbutoxycarbonyl)alaninate
3(4CHLOROPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL2((TERTBUTOXY)CARBONYLAMINO)PROPANOATE
CC(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)Cl)NC(=O)OC(C)(C)C
InChI=1SC24H21ClF3NO7c112(2922(32)3623(23)4)21(31)34159101617(1115)3520(24(2627)28)19(18(16)30)33147513(25)6814h512H14H3(H2932)
MFCD00306291
ZINC000003142821
ZINC000003142822
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