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

Systemtic Name: (2E)-2-[(1-methylindol-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2E)-6-hydroxy-2-[(1-methylindol-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)benzofuran-3-one CAS Name: (2E)-6-hydroxy-2-[(1-methyl-3-indolyl)methylidene]-7-(4-morpholin-4-iumylmethyl)-3-benzofuranone IUPAC Name: (2E)-6-hydroxy-2-[(1-methylindol-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-1-benzofuran-3-one Traditional Name: (2E)-6-hydroxy-2-[(1-methylindol-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)coumaran-3-one Formula: C23H23N2O4+ MolecularWeight: 391.43972

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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/p+1/b21-12+