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

Systemtic Name: methyl (2Z)-2-[(3-ethoxy-4-propoxy-phenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[(3-ethoxy-4-propoxy-phenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-2-(3-ethoxy-4-propoxy-benzylidene)-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OCC

InChI

InChI=1S/C22H22O6/c1-4-10-27-18-8-6-14(11-19(18)26-5-2)12-20-21(23)16-13-15(22(24)25-3)7-9-17(16)28-20/h6-9,11-13H,4-5,10H2,1-3H3/b20-12-