methyl (2Z)-2-[(4-hexoxy-3-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate

Systemtic Name: methyl (2Z)-2-[(4-hexoxy-3-methoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[(4-hexoxy-3-methoxy-phenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[(4-hexoxy-3-methoxyphenyl)methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[(4-hexoxy-3-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-2-(4-hexoxy-3-methoxy-benzylidene)-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C24H26O6 MolecularWeight: 410.45964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C24H26O6/c1-4-5-6-7-12-29-20-10-8-16(13-21(20)27-2)14-22-23(25)18-15-17(24(26)28-3)9-11-19(18)30-22/h8-11,13-15H,4-7,12H2,1-3H3/b22-14-