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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C=C2C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C22H22O6/c1-13(2)12-27-18-7-5-14(9-19(18)25-3)10-20-21(23)16-11-15(22(24)26-4)6-8-17(16)28-20/h5-11,13H,12H2,1-4H3/b20-10-