(2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-3-oxidanylidene-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate

Systemtic Name: (2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylidene]-3-oxidanylidene-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate Openeye Name: (2E)-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-3-oxo-7-(pyrrolidin-1-ium-1-ylmethyl)benzofuran-6-olate CAS Name: (2E)-2-[(5-methoxy-1-methyl-3-indolyl)methylidene]-3-oxo-7-(1-pyrrolidin-1-iumylmethyl)-6-benzofuranolate IUPAC Name: (2E)-2-[(5-methoxy-1-methylindol-3-yl)methylidene]-3-oxo-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate Traditional Name: (2E)-3-keto-2-[(5-methoxy-1-methyl-indol-3-yl)methylene]-7-(pyrrolidin-1-ium-1-ylmethyl)coumaran-6-olate Formula: C24H24N2O4 MolecularWeight: 404.45836

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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+]5CCCC5

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)/C=C/3\C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCCC5

InChI

InChI=1S/C24H24N2O4/c1-25-13-15(18-12-16(29-2)5-7-20(18)25)11-22-23(28)17-6-8-21(27)19(24(17)30-22)14-26-9-3-4-10-26/h5-8,11-13,27H,3-4,9-10,14H2,1-2H3/b22-11+