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

Systemtic Name: dibutyl-[[(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium Openeye Name: dibutyl-[[(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-3-oxo-benzofuran-7-yl]methyl]ammonium CAS Name: dibutyl-[[(2E)-6-hydroxy-2-[(5-methoxy-1-methyl-3-indolyl)methylidene]-3-oxo-7-benzofuranyl]methyl]ammonium IUPAC Name: dibutyl-[[(2E)-6-hydroxy-2-[(5-methoxy-1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-7-yl]methyl]azanium Traditional Name: dibutyl-[[(2E)-6-hydroxy-3-keto-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]coumaran-7-yl]methyl]ammonium Formula: C28H35N2O4+ MolecularWeight: 463.5885

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=C3C=C(C=C4)OC)C)C2=O)O

Isomeric SMILES

CCCC[NH+](CCCC)CC1=C(C=CC2=C1O/C(=C/C3=CN(C4=C3C=C(C=C4)OC)C)/C2=O)O

InChI

InChI=1S/C28H34N2O4/c1-5-7-13-30(14-8-6-2)18-23-25(31)12-10-21-27(32)26(34-28(21)23)15-19-17-29(3)24-11-9-20(33-4)16-22(19)24/h9-12,15-17,31H,5-8,13-14,18H2,1-4H3/p+1/b26-15+