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

Systemtic Name: methyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxidanylidene-1-benzofuran-5-carboxylate Openeye Name: methyl (2Z)-2-[(2-nitrophenyl)methylene]-3-oxo-benzofuran-5-carboxylate CAS Name: (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxo-5-benzofurancarboxylic acid methyl ester IUPAC Name: methyl (2Z)-2-[(2-nitrophenyl)methylidene]-3-oxo-1-benzofuran-5-carboxylate Traditional Name: (2Z)-3-keto-2-(2-nitrobenzylidene)coumaran-5-carboxylic acid methyl ester Formula: C17H11NO6 MolecularWeight: 325.27234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=CC3=CC=CC=C3[N+](=O)[O-])C2=O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)O/C(=C\C3=CC=CC=C3[N+](=O)[O-])/C2=O

InChI

InChI=1S/C17H11NO6/c1-23-17(20)11-6-7-14-12(8-11)16(19)15(24-14)9-10-4-2-3-5-13(10)18(21)22/h2-9H,1H3/b15-9-