[(2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-methylbenzoate

Systemtic Name: [(2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 4-methylbenzoate Openeye Name: [(2Z)-2-[(4-tert-butylphenyl)methylene]-3-oxo-benzofuran-6-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(4-tert-butylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2Z)-2-(4-tert-butylbenzylidene)-3-keto-coumaran-6-yl] ester Formula: C27H24O4 MolecularWeight: 412.47706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=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(=O)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=C(C=C4)C(C)(C)C)/O3

InChI

InChI=1S/C27H24O4/c1-17-5-9-19(10-6-17)26(29)30-21-13-14-22-23(16-21)31-24(25(22)28)15-18-7-11-20(12-8-18)27(2,3)4/h5-16H,1-4H3/b24-15-