methyl (2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate

Systemtic Name: methyl (2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[(4-tert-butylphenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-2-(4-tert-butylbenzylidene)-3-keto-coumaran-5-carboxylic acid methyl ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20O4/c1-21(2,3)15-8-5-13(6-9-15)11-18-19(22)16-12-14(20(23)24-4)7-10-17(16)25-18/h5-12H,1-4H3/b18-11-