[(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: [(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-3-indolyl)methylidene]-3-oxo-7-benzofuranyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[(2E)-6-hydroxy-2-[(5-methoxy-1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: benzyl-[[(2E)-6-hydroxy-3-keto-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]coumaran-7-yl]methyl]-methyl-ammonium Formula: C28H27N2O4+ MolecularWeight: 455.52498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)O)C[NH+](C)CC5=CC=CC=C5

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)/C=C/3\C(=O)C4=C(O3)C(=C(C=C4)O)C[NH+](C)CC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O4/c1-29(15-18-7-5-4-6-8-18)17-23-25(31)12-10-21-27(32)26(34-28(21)23)13-19-16-30(2)24-11-9-20(33-3)14-22(19)24/h4-14,16,31H,15,17H2,1-3H3/p+1/b26-13+