[(2Z)-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] benzoate

Systemtic Name: [(2Z)-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] benzoate Openeye Name: [(2Z)-3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl] benzoate CAS Name: benzoic acid [(2Z)-3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl] ester IUPAC Name: [(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] benzoate Traditional Name: benzoic acid [(2Z)-3-keto-2-(3-pyridylmethylene)coumaran-6-yl] ester Formula: C21H13NO4 MolecularWeight: 343.33222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CN=CC=C4)O3

Isomeric SMILES

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

InChI

InChI=1S/C21H13NO4/c23-20-17-9-8-16(25-21(24)15-6-2-1-3-7-15)12-18(17)26-19(20)11-14-5-4-10-22-13-14/h1-13H/b19-11-