(2Z)-7-[(dibutylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[(dibutylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(dibutylammonio)methyl]-2-[(1-ethylindol-3-yl)methylene]-3-oxo-benzofuran-6-olate CAS Name: (2Z)-7-[(dibutylammonio)methyl]-2-[(1-ethyl-3-indolyl)methylidene]-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-7-[(dibutylazaniumyl)methyl]-2-[(1-ethylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-7-[(dibutylammonio)methyl]-2-[(1-ethylindol-3-yl)methylene]-3-keto-coumaran-6-olate Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)CC)C2=O)[O-]

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(C=CC2=C1O/C(=C\C3=CN(C4=CC=CC=C43)CC)/C2=O)[O-]

InChI

InChI=1S/C28H34N2O3/c1-4-7-15-29(16-8-5-2)19-23-25(31)14-13-22-27(32)26(33-28(22)23)17-20-18-30(6-3)24-12-10-9-11-21(20)24/h9-14,17-18,31H,4-8,15-16,19H2,1-3H3/b26-17-