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

Systemtic Name: [(2Z)-6-oxidanyl-3-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-7-yl]methyl-dipropyl-azanium Openeye Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylene]benzofuran-7-yl]methyl-dipropyl-ammonium CAS Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-7-benzofuranyl]methyl-dipropylammonium IUPAC Name: [(2Z)-6-hydroxy-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-7-yl]methyl-dipropylazanium Traditional Name: [(2Z)-6-hydroxy-3-keto-2-(3,4,5-trimethoxybenzylidene)coumaran-7-yl]methyl-dipropyl-ammonium Formula: C25H32NO6+ MolecularWeight: 442.52468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO6/c1-6-10-26(11-7-2)15-18-19(27)9-8-17-23(28)20(32-24(17)18)12-16-13-21(29-3)25(31-5)22(14-16)30-4/h8-9,12-14,27H,6-7,10-11,15H2,1-5H3/p+1/b20-12-