3-[2-cyanoethyl-(2-nitrophenyl)amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-(2-nitrophenyl)amino]propanenitrile Openeye Name: 3-[N-(2-cyanoethyl)-2-nitro-anilino]propanenitrile CAS Name: 3-[N-(2-cyanoethyl)-2-nitroanilino]propanenitrile IUPAC Name: 3-[N-(2-cyanoethyl)-2-nitroanilino]propanenitrile Traditional Name: 3-[N-(2-cyanoethyl)-2-nitro-anilino]propionitrile Formula: C12H12N4O2 MolecularWeight: 244.24928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O2/c13-7-3-9-15(10-4-8-14)11-5-1-2-6-12(11)16(17)18/h1-2,5-6H,3-4,9-10H2