N-[4-(cyanomethyl)phenyl]-2-nitro-ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-nitro-ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-nitro-acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-nitroacetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-nitroacetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-nitro-acetamide Formula: C10H9N3O3 MolecularWeight: 219.19676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)C[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)C[N+](=O)[O-]

InChI

InChI=1S/C10H9N3O3/c11-6-5-8-1-3-9(4-2-8)12-10(14)7-13(15)16/h1-4H,5,7H2,(H,12,14)