(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 5-(4-nitrophenyl)furan-2-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 5-(4-nitrophenyl)furan-2-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 5-(4-nitrophenyl)furan-2-carboxylate CAS Name: 5-(4-nitrophenyl)-2-furancarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 5-(4-nitrophenyl)furan-2-carboxylate Traditional Name: 5-(4-nitrophenyl)furan-2-carboxylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC=C(O1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c1-10(19)13(8-18)14(21)9-25-17(22)16-7-6-15(26-16)11-2-4-12(5-3-11)20(23)24/h2-7,13,19H,9H2,1H3