methyl 4-[[2-[(2-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[2-[(2-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[2-(o-tolylmethylene)-3-oxo-benzofuran-6-yl]oxymethyl]benzoate CAS Name: 4-[[2-[(2-methylphenyl)methylidene]-3-oxo-6-benzofuranyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2-methylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate Traditional Name: 4-[[3-keto-2-(2-methylbenzylidene)coumaran-6-yl]oxymethyl]benzoic acid methyl ester Formula: C25H20O5 MolecularWeight: 400.4233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H20O5/c1-16-5-3-4-6-19(16)13-23-24(26)21-12-11-20(14-22(21)30-23)29-15-17-7-9-18(10-8-17)25(27)28-2/h3-14H,15H2,1-2H3