[(2E)-2-(1H-indol-3-ylmethylidene)-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [(2E)-2-(1H-indol-3-ylmethylidene)-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[(2E)-6-hydroxy-2-(1H-indol-3-ylmethylene)-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: [(2E)-6-hydroxy-2-(1H-indol-3-ylmethylidene)-3-oxo-7-benzofuranyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[(2E)-6-hydroxy-2-(1H-indol-3-ylmethylidene)-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: benzyl-[[(2E)-6-hydroxy-2-(1H-indol-3-ylmethylene)-3-keto-coumaran-7-yl]methyl]-methyl-ammonium Formula: C26H23N2O3+ MolecularWeight: 411.47242

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CNC5=CC=CC=C54)C3=O)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2O/C(=C/C4=CNC5=CC=CC=C54)/C3=O)O

InChI

InChI=1S/C26H22N2O3/c1-28(15-17-7-3-2-4-8-17)16-21-23(29)12-11-20-25(30)24(31-26(20)21)13-18-14-27-22-10-6-5-9-19(18)22/h2-14,27,29H,15-16H2,1H3/p+1/b24-13+