(2Z)-2-[(2-bromophenyl)methylidene]-7-[(dimethylazaniumyl)methyl]-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-2-[(2-bromophenyl)methylidene]-7-[(dimethylazaniumyl)methyl]-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-2-[(2-bromophenyl)methylene]-7-[(dimethylammonio)methyl]-3-oxo-benzofuran-6-olate CAS Name: (2Z)-2-[(2-bromophenyl)methylidene]-7-[(dimethylammonio)methyl]-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-2-[(2-bromophenyl)methylidene]-7-[(dimethylazaniumyl)methyl]-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-2-(2-bromobenzylidene)-7-[(dimethylammonio)methyl]-3-keto-coumaran-6-olate Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC2=C1OC(=CC3=CC=CC=C3Br)C2=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=C(C=CC2=C1O/C(=C\C3=CC=CC=C3Br)/C2=O)[O-]

InChI

InChI=1S/C18H16BrNO3/c1-20(2)10-13-15(21)8-7-12-17(22)16(23-18(12)13)9-11-5-3-4-6-14(11)19/h3-9,21H,10H2,1-2H3/b16-9-