ethyl 3-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(5-nitro-2-oxo-1-pyridyl)methyl]benzofuran-2-carboxylate CAS Name: 3-[(5-nitro-2-oxo-1-pyridinyl)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-nitro-2-oxopyridin-1-yl)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(2-keto-5-nitro-1-pyridyl)methyl]coumarilic acid ethyl ester Formula: C17H14N2O6 MolecularWeight: 342.30286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O6/c1-2-24-17(21)16-13(12-5-3-4-6-14(12)25-16)10-18-9-11(19(22)23)7-8-15(18)20/h3-9H,2,10H2,1H3