2-[(4-tert-butylphenyl)methylidene]-6-[(2,5-dimethylphenyl)methoxy]-1-benzofuran-3-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylidene]-6-[(2,5-dimethylphenyl)methoxy]-1-benzofuran-3-one Openeye Name: 2-[(4-tert-butylphenyl)methylene]-6-[(2,5-dimethylphenyl)methoxy]benzofuran-3-one CAS Name: 2-[(4-tert-butylphenyl)methylidene]-6-[(2,5-dimethylphenyl)methoxy]-3-benzofuranone IUPAC Name: 2-[(4-tert-butylphenyl)methylidene]-6-[(2,5-dimethylphenyl)methoxy]-1-benzofuran-3-one Traditional Name: 2-(4-tert-butylbenzylidene)-6-(2,5-dimethylbenzyl)oxy-coumaran-3-one Formula: C28H28O3 MolecularWeight: 412.52012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C(C)(C)C)O3

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)C(C)(C)C)O3

InChI

InChI=1S/C28H28O3/c1-18-6-7-19(2)21(14-18)17-30-23-12-13-24-25(16-23)31-26(27(24)29)15-20-8-10-22(11-9-20)28(3,4)5/h6-16H,17H2,1-5H3