Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-7-[(4-nitrobenzyl)oxy]-2-(trifluoromethyl)-4H-chromen-4-one
Catalog ID
STK612751
SMILES COc1ccc(cc1OC)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCc1ccc(cc1)[N+](=O)[O-]
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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 C25H18F3NO7 MW 501.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18F3NO7/c1-33-19-10-5-15(11-21(19)34-2)22-23(30)18-9-8-17(12-20(18)36-24(22)25(26,27)28)35-13-14-3-6-16(7-4-14)29(31)32/h3-12H,13H2,1-2H3InChIKey
YLDHRSOGBAHVDN-UHFFFAOYSA-NSynonyms
671210-82-53(34dimethoxyphenyl)7((4nitrobenzyl)oxy)2(trifluoromethyl)4Hchromen4one
3(34DIMETHOXYPHENYL)7((4NITROPHENYL)METHOXY)2(TRIFLUOROMETHYL)CHROMEN4ONE
671210825
COC1=C(C=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(C=C4)(N+)(=O)(O))C(F)(F)F)OC
COc1ccc(cc1OC)c1c(=O)c2ccc(cc2oc1C(F)(F)F)OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H18F3NO7c1331910515(1121(19)342)2223(30)189817(1220(18)3624(22)25(2627)28)3513143616(7414)29(31)32h312H13H212H3
MFCD04178027
ZINC000001940989
ZINC01940989
ZINC1940989
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