(2E)-2-[(1-methylindol-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2E)-2-[(1-methylindol-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2E)-2-[(1-methylindol-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-benzofuran-6-olate CAS Name: (2E)-2-[(1-methyl-3-indolyl)methylidene]-7-(4-morpholin-4-iumylmethyl)-3-oxo-6-benzofuranolate IUPAC Name: (2E)-2-[(1-methylindol-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-1-benzofuran-6-olate Traditional Name: (2E)-3-keto-2-[(1-methylindol-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)coumaran-6-olate Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCOCC5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=C/3\C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCOCC5

InChI

InChI=1S/C23H22N2O4/c1-24-13-15(16-4-2-3-5-19(16)24)12-21-22(27)17-6-7-20(26)18(23(17)29-21)14-25-8-10-28-11-9-25/h2-7,12-13,26H,8-11,14H2,1H3/b21-12+