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

Systemtic Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-diethyl-azanium Openeye Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methyl-diethyl-ammonium CAS Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-3-oxo-7-benzofuranyl]methyl-diethylammonium IUPAC Name: [(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-6-hydroxy-3-oxo-1-benzofuran-7-yl]methyl-diethylazanium Traditional Name: diethyl-[[(2Z)-6-hydroxy-3-keto-2-veratrylidene-coumaran-7-yl]methyl]ammonium Formula: C22H26NO5+ MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO5/c1-5-23(6-2)13-16-17(24)9-8-15-21(25)20(28-22(15)16)12-14-7-10-18(26-3)19(11-14)27-4/h7-12,24H,5-6,13H2,1-4H3/p+1/b20-12-