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

Systemtic Name: [(2Z)-2-[(5-bromanyl-1-benzofuran-2-yl)methylidene]-4-methyl-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-butyl-methyl-azanium Openeye Name: [(2Z)-2-[(5-bromobenzofuran-2-yl)methylene]-6-hydroxy-4-methyl-3-oxo-benzofuran-7-yl]methyl-butyl-methyl-ammonium CAS Name: [(2Z)-2-[(5-bromo-2-benzofuranyl)methylidene]-6-hydroxy-4-methyl-3-oxo-7-benzofuranyl]methyl-butyl-methylammonium IUPAC Name: [(2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-6-hydroxy-4-methyl-3-oxo-1-benzofuran-7-yl]methyl-butyl-methylazanium Traditional Name: [(2Z)-2-[(5-bromobenzofuran-2-yl)methylene]-6-hydroxy-3-keto-4-methyl-coumaran-7-yl]methyl-butyl-methyl-ammonium Formula: C24H25BrNO4+ MolecularWeight: 471.3636

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=C(C2=C1OC(=CC3=CC4=C(O3)C=CC(=C4)Br)C2=O)C)O

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=C(C2=C1O/C(=C\C3=CC4=C(O3)C=CC(=C4)Br)/C2=O)C)O

InChI

InChI=1S/C24H24BrNO4/c1-4-5-8-26(3)13-18-19(27)9-14(2)22-23(28)21(30-24(18)22)12-17-11-15-10-16(25)6-7-20(15)29-17/h6-7,9-12,27H,4-5,8,13H2,1-3H3/p+1/b21-12-