Vitas-M small molecule compound
(2Z)-7-[(dimethylammonio)methyl]-2-(4-fluorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK856379
SMILES Fc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](C)C)[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 C18H16FNO3 MW 313.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FNO3/c1-20(2)10-14-15(21)8-7-13-17(22)16(23-18(13)14)9-11-3-5-12(19)6-4-11/h3-9,21H,10H2,1-2H3/b16-9-InChIKey
PELLYWQDQTXWEE-SXGWCWSVSA-NSynonyms
869076-98-2(2Z)7((dimethylamino)methyl)2((4fluorophenyl)methylidene)6hydroxy1benzofuran3one
(2Z)7((dimethylammonio)methyl)2(4fluorobenzylidene)3oxo23dihydro1benzofuran6olate
869076982
CN(C)CC1=C(C=CC2=C1OC(=CC3=CC=C(C=C3)F)C2=O)O
Fc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2C(NH+)(C)C)(O)
InChI=1SC18H16FNO3c120(2)101415(21)871317(22)16(2318(13)14)9113512(19)6411h3921H10H212H3b169
MFCD06405708
ZINC000020624399
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