2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]acetonitrile CAS Name: 2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[1-(3-bromophenyl)ethylamino]phenoxy]acetonitrile Formula: C16H15BrN2O MolecularWeight: 331.2071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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