(2Z)-7-[(dibutylazaniumyl)methyl]-2-[(5-methylfuran-2-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[(dibutylazaniumyl)methyl]-2-[(5-methylfuran-2-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-7-[(dibutylammonio)methyl]-2-[(5-methyl-2-furyl)methylene]-3-oxo-benzofuran-6-olate CAS Name: (2Z)-7-[(dibutylammonio)methyl]-2-[(5-methyl-2-furanyl)methylidene]-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-7-[(dibutylazaniumyl)methyl]-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-7-[(dibutylammonio)methyl]-3-keto-2-[(5-methyl-2-furyl)methylene]coumaran-6-olate Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC(=CC3=CC=C(O3)C)C2=O)[O-]

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(C=CC2=C1O/C(=C\C3=CC=C(O3)C)/C2=O)[O-]

InChI

InChI=1S/C23H29NO4/c1-4-6-12-24(13-7-5-2)15-19-20(25)11-10-18-22(26)21(28-23(18)19)14-17-9-8-16(3)27-17/h8-11,14,25H,4-7,12-13,15H2,1-3H3/b21-14-