(2Z)-7-[(dimethylazaniumyl)methyl]-3-oxidanylidene-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[(dimethylazaniumyl)methyl]-3-oxidanylidene-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(dimethylammonio)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-olate CAS Name: (2Z)-7-[(dimethylammonio)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-6-benzofuranolate IUPAC Name: (2Z)-7-[(dimethylazaniumyl)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Traditional Name: (2Z)-7-[(dimethylammonio)methyl]-3-keto-2-[(E)-3-phenylprop-2-enylidene]coumaran-6-olate Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO3/c1-21(2)13-16-17(22)12-11-15-19(23)18(24-20(15)16)10-6-9-14-7-4-3-5-8-14/h3-12,22H,13H2,1-2H3/b9-6+,18-10-