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

Systemtic Name: butyl-[[2-[(3,4-dimethoxyphenyl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]-methyl-azanium Openeye Name: butyl-[[2-[(3,4-dimethoxyphenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: butyl-[[2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-3-oxo-7-benzofuranyl]methyl]-methylammonium IUPAC Name: butyl-[[2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: butyl-[(6-hydroxy-3-keto-2-veratrylidene-coumaran-7-yl)methyl]-methyl-ammonium Formula: C23H28NO5+ MolecularWeight: 398.47212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO5/c1-5-6-11-24(2)14-17-18(25)9-8-16-22(26)21(29-23(16)17)13-15-7-10-19(27-3)20(12-15)28-4/h7-10,12-13,25H,5-6,11,14H2,1-4H3/p+1