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

Systemtic Name: (2Z)-2-[(4-methoxycarbonylphenyl)methylidene]-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxidanylidene-1-benzofuran-6-olate Openeye Name: (2Z)-2-[(4-methoxycarbonylphenyl)methylene]-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-benzofuran-6-olate CAS Name: (2Z)-2-[(4-methoxycarbonylphenyl)methylidene]-4-methyl-7-(4-morpholin-4-iumylmethyl)-3-oxo-6-benzofuranolate IUPAC Name: (2Z)-2-[(4-methoxycarbonylphenyl)methylidene]-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-3-oxo-1-benzofuran-6-olate Traditional Name: (2Z)-2-(4-carbomethoxybenzylidene)-3-keto-4-methyl-7-(morpholin-4-ium-4-ylmethyl)coumaran-6-olate Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)O2)C[NH+]4CCOCC4)[O-]

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C/C3=CC=C(C=C3)C(=O)OC)/O2)C[NH+]4CCOCC4)[O-]

InChI

InChI=1S/C23H23NO6/c1-14-11-18(25)17(13-24-7-9-29-10-8-24)22-20(14)21(26)19(30-22)12-15-3-5-16(6-4-15)23(27)28-2/h3-6,11-12,25H,7-10,13H2,1-2H3/b19-12-