2-[(4-nitrophenyl)amino]ethanenitrile

Systemtic Name: 2-[(4-nitrophenyl)amino]ethanenitrile Openeye Name: 2-(4-nitroanilino)acetonitrile CAS Name: 2-(4-nitroanilino)acetonitrile IUPAC Name: 2-(4-nitroanilino)acetonitrile Traditional Name: 2-(4-nitroanilino)acetonitrile Formula: C8H7N3O2 MolecularWeight: 177.16008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCC#N)[N+](=O)[O-]

InChI

InChI=1S/C8H7N3O2/c9-5-6-10-7-1-3-8(4-2-7)11(12)13/h1-4,10H,6H2