2-[3-(2,6-dimethylheptan-4-ylamino)phenoxy]ethanenitrile

Systemtic Name: 2-[3-(2,6-dimethylheptan-4-ylamino)phenoxy]ethanenitrile Openeye Name: 2-[3-[(1-isobutyl-3-methyl-butyl)amino]phenoxy]acetonitrile CAS Name: 2-[3-(2,6-dimethylheptan-4-ylamino)phenoxy]acetonitrile IUPAC Name: 2-[3-(2,6-dimethylheptan-4-ylamino)phenoxy]acetonitrile Traditional Name: 2-[3-[(1-isobutyl-3-methyl-butyl)amino]phenoxy]acetonitrile Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-13(2)10-16(11-14(3)4)19-15-6-5-7-17(12-15)20-9-8-18/h5-7,12-14,16,19H,9-11H2,1-4H3