methyl 3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-5-carboxylate

Systemtic Name: methyl 3-oxidanylidene-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-5-carboxylate Openeye Name: methyl 2-[(4-isopropylphenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: 3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-5-carboxylate Traditional Name: 2-(4-isopropylbenzylidene)-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O4/c1-12(2)14-6-4-13(5-7-14)10-18-19(21)16-11-15(20(22)23-3)8-9-17(16)24-18/h4-12H,1-3H3