[(2Z)-2-(furan-2-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 4-methylbenzoate

Systemtic Name: [(2Z)-2-(furan-2-ylmethylidene)-3-oxidanylidene-1-benzofuran-6-yl] 4-methylbenzoate Openeye Name: [(2Z)-2-(2-furylmethylene)-3-oxo-benzofuran-6-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(2Z)-2-(2-furanylmethylidene)-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-(furan-2-ylmethylidene)-3-oxo-1-benzofuran-6-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(2Z)-2-(2-furfurylidene)-3-keto-coumaran-6-yl] ester Formula: C21H14O5 MolecularWeight: 346.33286

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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=CO4)O3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=CO4)/O3

InChI

InChI=1S/C21H14O5/c1-13-4-6-14(7-5-13)21(23)25-16-8-9-17-18(12-16)26-19(20(17)22)11-15-3-2-10-24-15/h2-12H,1H3/b19-11-