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

Systemtic Name: (2Z)-7-[[butyl(methyl)azaniumyl]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-7-[[butyl(methyl)ammonio]methyl]-2-(1H-indol-3-ylmethylene)-3-oxo-benzofuran-6-olate CAS Name: (2Z)-7-[[butyl(methyl)ammonio]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-7-[[butyl(methyl)azaniumyl]methyl]-2-(1H-indol-3-ylmethylidene)-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-7-[[butyl(methyl)ammonio]methyl]-2-(1H-indol-3-ylmethylene)-3-keto-coumaran-6-olate Formula: C23H24N2O3 MolecularWeight: 376.44826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O3/c1-3-4-11-25(2)14-18-20(26)10-9-17-22(27)21(28-23(17)18)12-15-13-24-19-8-6-5-7-16(15)19/h5-10,12-13,24,26H,3-4,11,14H2,1-2H3/b21-12-