2-[2-[[(3-nitrophenyl)amino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-[[(3-nitrophenyl)amino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-[(3-nitroanilino)methyl]phenoxy]acetonitrile CAS Name: 2-[2-[(3-nitroanilino)methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-[(3-nitroanilino)methyl]phenoxy]acetonitrile Traditional Name: 2-[2-[(3-nitroanilino)methyl]phenoxy]acetonitrile Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=CC(=CC=C2)[N+](=O)[O-])OCC#N

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=CC(=CC=C2)[N+](=O)[O-])OCC#N

InChI

InChI=1S/C15H13N3O3/c16-8-9-21-15-7-2-1-4-12(15)11-17-13-5-3-6-14(10-13)18(19)20/h1-7,10,17H,9,11H2