2-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]phenoxy]ethanenitrile Openeye Name: 2-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]phenoxy]acetonitrile CAS Name: 2-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]phenoxy]acetonitrile IUPAC Name: 2-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]phenoxy]acetonitrile Traditional Name: 2-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]phenoxy]acetonitrile Formula: C16H15ClN2O2 MolecularWeight: 302.7555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(CNC2=CC=C(C=C2)OCC#N)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(CNC2=CC=C(C=C2)OCC#N)O

InChI

InChI=1S/C16H15ClN2O2/c17-13-3-1-2-12(10-13)16(20)11-19-14-4-6-15(7-5-14)21-9-8-18/h1-7,10,16,19-20H,9,11H2