3-[(5-nitropyridin-2-yl)-phenyl-amino]propanenitrile

Systemtic Name: 3-[(5-nitropyridin-2-yl)-phenyl-amino]propanenitrile Openeye Name: 3-(N-(5-nitro-2-pyridyl)anilino)propanenitrile CAS Name: 3-(N-(5-nitro-2-pyridinyl)anilino)propanenitrile IUPAC Name: 3-(N-(5-nitropyridin-2-yl)anilino)propanenitrile Traditional Name: 3-(N-(5-nitro-2-pyridyl)anilino)propionitrile Formula: C14H12N4O2 MolecularWeight: 268.27068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O2/c15-9-4-10-17(12-5-2-1-3-6-12)14-8-7-13(11-16-14)18(19)20/h1-3,5-8,11H,4,10H2