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

Systemtic Name: (2Z)-7-[(diethylazaniumyl)methyl]-3-oxidanylidene-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(diethylammonio)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-olate CAS Name: (2Z)-7-[(diethylammonio)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-6-benzofuranolate IUPAC Name: (2Z)-7-[(diethylazaniumyl)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Traditional Name: (2Z)-7-[(diethylammonio)methyl]-3-keto-2-[(E)-3-phenylprop-2-enylidene]coumaran-6-olate Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3/c1-3-23(4-2)15-18-19(24)14-13-17-21(25)20(26-22(17)18)12-8-11-16-9-6-5-7-10-16/h5-14,24H,3-4,15H2,1-2H3/b11-8+,20-12-