(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-nitrophenoxy)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-nitrophenoxy)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c1-9(16)10(6-15)12(18)7-23-14(19)8-22-13-5-3-2-4-11(13)17(20)21/h2-5,10,16H,7-8H2,1H3