(2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxidanylidene-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxidanylidene-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-6-olate CAS Name: (2Z)-7-[(4-methyl-1-piperazin-1-iumyl)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-6-benzofuranolate IUPAC Name: (2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-6-olate Traditional Name: (2Z)-3-keto-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-[(E)-3-phenylprop-2-enylidene]coumaran-6-olate Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC=CC4=CC=CC=C4)C3=O)[O-]

Isomeric SMILES

CN1CC[NH+](CC1)CC2=C(C=CC3=C2O/C(=C\C=C\C4=CC=CC=C4)/C3=O)[O-]

InChI

InChI=1S/C23H24N2O3/c1-24-12-14-25(15-13-24)16-19-20(26)11-10-18-22(27)21(28-23(18)19)9-5-8-17-6-3-2-4-7-17/h2-11,26H,12-16H2,1H3/b8-5+,21-9-