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

Systemtic Name: (2Z)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylidene]-3-oxidanylidene-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate Openeye Name: (2Z)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-3-oxo-7-(pyrrolidin-1-ium-1-ylmethyl)benzofuran-6-olate CAS Name: (2Z)-2-[(1-ethyl-5-methoxy-3-indolyl)methylidene]-3-oxo-7-(1-pyrrolidin-1-iumylmethyl)-6-benzofuranolate IUPAC Name: (2Z)-2-[(1-ethyl-5-methoxyindol-3-yl)methylidene]-3-oxo-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate Traditional Name: (2Z)-2-[(1-ethyl-5-methoxy-indol-3-yl)methylene]-3-keto-7-(pyrrolidin-1-ium-1-ylmethyl)coumaran-6-olate Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCCC5

Isomeric SMILES

CCN1C=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/C25H26N2O4/c1-3-27-14-16(19-13-17(30-2)6-8-21(19)27)12-23-24(29)18-7-9-22(28)20(25(18)31-23)15-26-10-4-5-11-26/h6-9,12-14,28H,3-5,10-11,15H2,1-2H3/b23-12-