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

Systemtic Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-4-methyl-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-dimethyl-azanium Openeye Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylene]-6-hydroxy-4-methyl-3-oxo-benzofuran-7-yl]methyl-dimethyl-ammonium CAS Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-4-methyl-3-oxo-7-benzofuranyl]methyl-dimethylammonium IUPAC Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-4-methyl-3-oxo-1-benzofuran-7-yl]methyl-dimethylazanium Traditional Name: [(2Z)-6-hydroxy-3-keto-4-methyl-2-veratrylidene-coumaran-7-yl]methyl-dimethyl-ammonium Formula: C21H24NO5+ MolecularWeight: 370.41896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC(=C(C=C3)OC)OC)O2)C[NH+](C)C)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C/C3=CC(=C(C=C3)OC)OC)/O2)C[NH+](C)C)O

InChI

InChI=1S/C21H23NO5/c1-12-8-15(23)14(11-22(2)3)21-19(12)20(24)18(27-21)10-13-6-7-16(25-4)17(9-13)26-5/h6-10,23H,11H2,1-5H3/p+1/b18-10-