N-[4-(1-cyanoethyl)-2-nitro-phenyl]ethanamide

Systemtic Name: N-[4-(1-cyanoethyl)-2-nitro-phenyl]ethanamide Openeye Name: N-[4-(1-cyanoethyl)-2-nitro-phenyl]acetamide CAS Name: N-[4-(1-cyanoethyl)-2-nitrophenyl]acetamide IUPAC Name: N-[4-(1-cyanoethyl)-2-nitrophenyl]acetamide Traditional Name: N-[4-(1-cyanoethyl)-2-nitro-phenyl]acetamide Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O3/c1-7(6-12)9-3-4-10(13-8(2)15)11(5-9)14(16)17/h3-5,7H,1-2H3,(H,13,15)