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

Systemtic Name: butyl-[[(2E)-2-[(1-ethylindol-3-yl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]-methyl-azanium Openeye Name: butyl-[[(2E)-2-[(1-ethylindol-3-yl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methyl]-methyl-ammonium CAS Name: butyl-[[(2E)-2-[(1-ethyl-3-indolyl)methylidene]-6-hydroxy-3-oxo-7-benzofuranyl]methyl]-methylammonium IUPAC Name: butyl-[[(2E)-2-[(1-ethylindol-3-yl)methylidene]-6-hydroxy-3-oxo-1-benzofuran-7-yl]methyl]-methylazanium Traditional Name: butyl-[[(2E)-2-[(1-ethylindol-3-yl)methylene]-6-hydroxy-3-keto-coumaran-7-yl]methyl]-methyl-ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)CC)C2=O)O

Isomeric SMILES

CCCC[NH+](C)CC1=C(C=CC2=C1O/C(=C/C3=CN(C4=CC=CC=C43)CC)/C2=O)O

InChI

InChI=1S/C25H28N2O3/c1-4-6-13-26(3)16-20-22(28)12-11-19-24(29)23(30-25(19)20)14-17-15-27(5-2)21-10-8-7-9-18(17)21/h7-12,14-15,28H,4-6,13,16H2,1-3H3/p+1/b23-14+