2-[4-[1-[(4-bromophenyl)amino]ethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[1-[(4-bromophenyl)amino]ethyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[1-(4-bromoanilino)ethyl]phenoxy]acetonitrile CAS Name: 2-[4-[1-(4-bromoanilino)ethyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[1-(4-bromoanilino)ethyl]phenoxy]acetonitrile Traditional Name: 2-[4-[1-(4-bromoanilino)ethyl]phenoxy]acetonitrile Formula: C16H15BrN2O MolecularWeight: 331.2071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCC#N)NC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C1=CC=C(C=C1)OCC#N)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H15BrN2O/c1-12(19-15-6-4-14(17)5-7-15)13-2-8-16(9-3-13)20-11-10-18/h2-9,12,19H,11H2,1H3