[(2Z)-3-oxidanylidene-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl] 4-nitrobenzoate

Systemtic Name: [(2Z)-3-oxidanylidene-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl] 4-nitrobenzoate Openeye Name: [(2Z)-3-oxo-2-[(4-phenylphenyl)methylene]benzofuran-6-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2Z)-3-oxo-2-[(4-phenylphenyl)methylidene]-6-benzofuranyl] ester IUPAC Name: [(2Z)-3-oxo-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2Z)-3-keto-2-(4-phenylbenzylidene)coumaran-6-yl] ester Formula: C28H17NO6 MolecularWeight: 463.43768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C\3/C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H17NO6/c30-27-24-15-14-23(34-28(31)21-10-12-22(13-11-21)29(32)33)17-25(24)35-26(27)16-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-17H/b26-16-