[(2Z)-2-[(3-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] (E)-3-phenylprop-2-enoate

Systemtic Name: [(2Z)-2-[(3-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] (E)-3-phenylprop-2-enoate Openeye Name: [(2Z)-2-(m-tolylmethylene)-3-oxo-benzofuran-6-yl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [(2Z)-2-[(3-methylphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(3-methylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [(2Z)-3-keto-2-(3-methylbenzylidene)coumaran-6-yl] ester Formula: C25H18O4 MolecularWeight: 382.40802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H18O4/c1-17-6-5-9-19(14-17)15-23-25(27)21-12-11-20(16-22(21)29-23)28-24(26)13-10-18-7-3-2-4-8-18/h2-16H,1H3/b13-10+,23-15-