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

Systemtic Name: 2-[3-[[(3-bromophenyl)amino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[3-[(3-bromoanilino)methyl]phenoxy]acetonitrile CAS Name: 2-[3-[(3-bromoanilino)methyl]phenoxy]acetonitrile IUPAC Name: 2-[3-[(3-bromoanilino)methyl]phenoxy]acetonitrile Traditional Name: 2-[3-[(3-bromoanilino)methyl]phenoxy]acetonitrile Formula: C15H13BrN2O MolecularWeight: 317.18052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)CNC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)CNC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H13BrN2O/c16-13-4-2-5-14(10-13)18-11-12-3-1-6-15(9-12)19-8-7-17/h1-6,9-10,18H,8,11H2