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

Systemtic Name: 2-[4-[1-(4-methyl-2-oxidanyl-phenyl)ethylamino]phenoxy]ethanenitrile Openeye Name: 2-[4-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]phenoxy]acetonitrile CAS Name: 2-[4-[1-(2-hydroxy-4-methylphenyl)ethylamino]phenoxy]acetonitrile IUPAC Name: 2-[4-[1-(2-hydroxy-4-methylphenyl)ethylamino]phenoxy]acetonitrile Traditional Name: 2-[4-[1-(2-hydroxy-4-methyl-phenyl)ethylamino]phenoxy]acetonitrile Formula: C17H18N2O2 MolecularWeight: 282.33702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC2=CC=C(C=C2)OCC#N)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC2=CC=C(C=C2)OCC#N)O

InChI

InChI=1S/C17H18N2O2/c1-12-3-8-16(17(20)11-12)13(2)19-14-4-6-15(7-5-14)21-10-9-18/h3-8,11,13,19-20H,10H2,1-2H3