(4-cyano-3-nitro-phenyl)methyl ethanoate

Systemtic Name: (4-cyano-3-nitro-phenyl)methyl ethanoate Openeye Name: (4-cyano-3-nitro-phenyl)methyl acetate CAS Name: acetic acid (4-cyano-3-nitrophenyl)methyl ester IUPAC Name: (4-cyano-3-nitrophenyl)methyl acetate Traditional Name: acetic acid (4-cyano-3-nitro-benzyl) ester Formula: C10H8N2O4 MolecularWeight: 220.18152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC(=C(C=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCC1=CC(=C(C=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C10H8N2O4/c1-7(13)16-6-8-2-3-9(5-11)10(4-8)12(14)15/h2-4H,6H2,1H3