[(2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] cyclopropanecarboxylate

Systemtic Name: [(2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] cyclopropanecarboxylate Openeye Name: [(2E)-2-[(3-nitrophenyl)methylene]-3-oxo-benzofuran-6-yl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [(2E)-2-[(3-nitrophenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2E)-2-[(3-nitrophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [(2E)-3-keto-2-(3-nitrobenzylidene)coumaran-6-yl] ester Formula: C19H13NO6 MolecularWeight: 351.30962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC(=CC=C4)[N+](=O)[O-])O3

Isomeric SMILES

C1CC1C(=O)OC2=CC3=C(C=C2)C(=O)/C(=C\C4=CC(=CC=C4)[N+](=O)[O-])/O3

InChI

InChI=1S/C19H13NO6/c21-18-15-7-6-14(25-19(22)12-4-5-12)10-16(15)26-17(18)9-11-2-1-3-13(8-11)20(23)24/h1-3,6-10,12H,4-5H2/b17-9+