(2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxidanylidene-1-benzofuran-6-olate

Systemtic Name: (2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-2-[(2-methyl-2H-chromen-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-benzofuran-6-olate CAS Name: (2Z)-2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-7-(4-morpholin-4-iumylmethyl)-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-2-[(2-methyl-2H-chromen-3-yl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-3-keto-2-[(2-methyl-2H-chromen-3-yl)methylene]-7-(morpholin-4-ium-4-ylmethyl)coumaran-6-olate Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CC2=CC=CC=C2O1)C=C3C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCOCC5

Isomeric SMILES

CC1C(=CC2=CC=CC=C2O1)/C=C\3/C(=O)C4=C(O3)C(=C(C=C4)[O-])C[NH+]5CCOCC5

InChI

InChI=1S/C24H23NO5/c1-15-17(12-16-4-2-3-5-21(16)29-15)13-22-23(27)18-6-7-20(26)19(24(18)30-22)14-25-8-10-28-11-9-25/h2-7,12-13,15,26H,8-11,14H2,1H3/b22-13-