[(2Z)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: [(2Z)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate Openeye Name: [(2Z)-2-[(3-nitrophenyl)methylene]-3-oxo-benzofuran-6-yl] 5-ethoxy-2-methyl-benzofuran-3-carboxylate CAS Name: 5-ethoxy-2-methyl-3-benzofurancarboxylic acid [(2Z)-2-[(3-nitrophenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(3-nitrophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 5-ethoxy-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-ethoxy-2-methyl-benzofuran-3-carboxylic acid [(2Z)-3-keto-2-(3-nitrobenzylidene)coumaran-6-yl] ester Formula: C27H19NO8 MolecularWeight: 485.44166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC(=CC=C5)[N+](=O)[O-])O4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)/C(=C/C5=CC(=CC=C5)[N+](=O)[O-])/O4)C

InChI

InChI=1S/C27H19NO8/c1-3-33-18-8-10-22-21(13-18)25(15(2)34-22)27(30)35-19-7-9-20-23(14-19)36-24(26(20)29)12-16-5-4-6-17(11-16)28(31)32/h4-14H,3H2,1-2H3/b24-12-