dimethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: dimethyl-[[(2Z)-6-oxidanyl-3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-7-yl]methyl]azanium Openeye Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-7-yl]methyl-dimethyl-ammonium CAS Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-7-benzofuranyl]methyl-dimethylammonium IUPAC Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-7-yl]methyl-dimethylazanium Traditional Name: [(2Z)-6-hydroxy-3-keto-2-(3,4,5-trimethoxybenzylidene)coumaran-7-yl]methyl-dimethyl-ammonium Formula: C21H24NO6+ MolecularWeight: 386.41836

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1OC(=CC3=CC(=C(C(=C3)OC)OC)OC)C2=O)O

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1O/C(=C\C3=CC(=C(C(=C3)OC)OC)OC)/C2=O)O

InChI

InChI=1S/C21H23NO6/c1-22(2)11-14-15(23)7-6-13-19(24)16(28-20(13)14)8-12-9-17(25-3)21(27-5)18(10-12)26-4/h6-10,23H,11H2,1-5H3/p+1/b16-8-