2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]acetonitrile CAS Name: 2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[[1-(2-bromophenyl)ethylamino]methyl]phenoxy]acetonitrile Formula: C17H17BrN2O MolecularWeight: 345.23368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NCC2=CC=C(C=C2)OCC#N

Isomeric SMILES

CC(C1=CC=CC=C1Br)NCC2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C17H17BrN2O/c1-13(16-4-2-3-5-17(16)18)20-12-14-6-8-15(9-7-14)21-11-10-19/h2-9,13,20H,11-12H2,1H3