(2Z)-7-[[bis(2-methoxyethyl)azaniumyl]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-7-[[bis(2-methoxyethyl)azaniumyl]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-7-[[bis(2-methoxyethyl)ammonio]methyl]-2-(1H-indol-3-ylmethylene)-3-oxo-benzofuran-6-olate CAS Name: (2Z)-7-[[bis(2-methoxyethyl)ammonio]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-7-[[bis(2-methoxyethyl)azaniumyl]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-7-[[bis(2-methoxyethyl)ammonio]methyl]-2-(1H-indol-3-ylmethylene)-3-keto-coumaran-6-olate Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CCOC)CC1=C(C=CC2=C1OC(=CC3=CNC4=CC=CC=C43)C2=O)[O-]

Isomeric SMILES

COCC[NH+](CCOC)CC1=C(C=CC2=C1O/C(=C\C3=CNC4=CC=CC=C43)/C2=O)[O-]

InChI

InChI=1S/C24H26N2O5/c1-29-11-9-26(10-12-30-2)15-19-21(27)8-7-18-23(28)22(31-24(18)19)13-16-14-25-20-6-4-3-5-17(16)20/h3-8,13-14,25,27H,9-12,15H2,1-2H3/b22-13-