3-[(4-nitrophenyl)methylamino]propanenitrile

Systemtic Name: 3-[(4-nitrophenyl)methylamino]propanenitrile Openeye Name: 3-[(4-nitrophenyl)methylamino]propanenitrile CAS Name: 3-[(4-nitrophenyl)methylamino]propanenitrile IUPAC Name: 3-[(4-nitrophenyl)methylamino]propanenitrile Traditional Name: 3-[(4-nitrobenzyl)amino]propionitrile Formula: C10H11N3O2 MolecularWeight: 205.21324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNCCC#N)[N+](=O)[O-]

InChI

InChI=1S/C10H11N3O2/c11-6-1-7-12-8-9-2-4-10(5-3-9)13(14)15/h2-5,12H,1,7-8H2