Vitas-M small molecule compound
(2Z)-2-[4-(difluoromethoxy)-3-methoxybenzylidene]-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Catalog ID
STL309129
SMILES COc1cc(ccc1OC(F)F)/C=C\1/Cc2c(C1=O)cc(c(c2)OC)OC
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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 C20H18F2O5 MW 376.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F2O5/c1-24-16-7-11(4-5-15(16)27-20(21)22)6-13-8-12-9-17(25-2)18(26-3)10-14(12)19(13)23/h4-7,9-10,20H,8H2,1-3H3/b13-6-InChIKey
MCMCRSYPDZECJQ-MLPAPPSSSA-NSynonyms
1436015-97-2(2Z)2((4(difluoromethoxy)3methoxyphenyl)methylidene)56dimethoxy3Hinden1one
(2Z)2(4(difluoromethoxy)3methoxybenzylidene)56dimethoxy23dihydro1Hinden1one
(Z)2(4(difluoromethoxy)3methoxybenzylidene)56dimethoxy23dihydro1Hinden1one
1436015972
COC1=C(C=C2C(=C1)CC(=CC3=CC(=C(C=C3)OC(F)F)OC)C2=O)OC
COc1cc(ccc1OC(F)F)C=C1Cc2c(C1=O)cc(c(c2)OC)OC
InChI=1SC20H18F2O5c12416711(4515(16)2720(21)22)613812917(252)18(263)1014(12)19(13)23h4791020H8H213H3b136
MFCD23137070
ZINC000095472340
ZINC95472340
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