[1-cyano-4-(2-nitrophenyl)butyl] ethanoate

Systemtic Name: [1-cyano-4-(2-nitrophenyl)butyl] ethanoate Openeye Name: [1-cyano-4-(2-nitrophenyl)butyl] acetate CAS Name: acetic acid [1-cyano-4-(2-nitrophenyl)butyl] ester IUPAC Name: [1-cyano-4-(2-nitrophenyl)butyl] acetate Traditional Name: acetic acid [1-cyano-4-(2-nitrophenyl)butyl] ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCC1=CC=CC=C1[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)OC(CCCC1=CC=CC=C1[N+](=O)[O-])C#N

InChI

InChI=1S/C13H14N2O4/c1-10(16)19-12(9-14)7-4-6-11-5-2-3-8-13(11)15(17)18/h2-3,5,8,12H,4,6-7H2,1H3