2-[4-(5-methylheptan-3-ylamino)phenoxy]ethanenitrile

Systemtic Name: 2-[4-(5-methylheptan-3-ylamino)phenoxy]ethanenitrile Openeye Name: 2-[4-[(1-ethyl-3-methyl-pentyl)amino]phenoxy]acetonitrile CAS Name: 2-[4-(5-methylheptan-3-ylamino)phenoxy]acetonitrile IUPAC Name: 2-[4-(5-methylheptan-3-ylamino)phenoxy]acetonitrile Traditional Name: 2-[4-[(1-ethyl-3-methyl-pentyl)amino]phenoxy]acetonitrile Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)NC1=CC=C(C=C1)OCC#N

Isomeric SMILES

CCC(C)CC(CC)NC1=CC=C(C=C1)OCC#N

InChI

InChI=1S/C16H24N2O/c1-4-13(3)12-14(5-2)18-15-6-8-16(9-7-15)19-11-10-17/h6-9,13-14,18H,4-5,11-12H2,1-3H3