2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]acetonitrile CAS Name: 2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]acetonitrile Traditional Name: 2-[4-[[(2-methylcyclohexyl)amino]methyl]phenoxy]acetonitrile Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NCC2=CC=C(C=C2)OCC#N

Isomeric SMILES

CC1CCCCC1NCC2=CC=C(C=C2)OCC#N

InChI

InChI=1S/C16H22N2O/c1-13-4-2-3-5-16(13)18-12-14-6-8-15(9-7-14)19-11-10-17/h6-9,13,16,18H,2-5,11-12H2,1H3