[(2E)-2-[(1-ethylindol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [(2E)-2-[(1-ethylindol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[(2E)-2-[(1-ethylindol-3-yl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: [(2E)-2-[(1-ethyl-3-indolyl)methylidene]-6-hydroxy-3-oxo-7-benzofuranyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[(2E)-2-[(1-ethylindol-3-yl)methylidene]-6-hydroxy-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: benzyl-[[(2E)-2-[(1-ethylindol-3-yl)methylene]-6-hydroxy-3-keto-coumaran-7-yl]methyl]-methyl-ammonium Formula: C28H27N2O3+ MolecularWeight: 439.52558

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C(=C(C=C4)O)C[NH+](C)CC5=CC=CC=C5

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)/C=C/3\C(=O)C4=C(O3)C(=C(C=C4)O)C[NH+](C)CC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O3/c1-3-30-17-20(21-11-7-8-12-24(21)30)15-26-27(32)22-13-14-25(31)23(28(22)33-26)18-29(2)16-19-9-5-4-6-10-19/h4-15,17,31H,3,16,18H2,1-2H3/p+1/b26-15+