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

Systemtic Name: 2-[4-(2,6-dimethylheptan-4-ylamino)phenyl]ethanenitrile Openeye Name: 2-[4-[(1-isobutyl-3-methyl-butyl)amino]phenyl]acetonitrile CAS Name: 2-[4-(2,6-dimethylheptan-4-ylamino)phenyl]acetonitrile IUPAC Name: 2-[4-(2,6-dimethylheptan-4-ylamino)phenyl]acetonitrile Traditional Name: 2-[4-[(1-isobutyl-3-methyl-butyl)amino]phenyl]acetonitrile Formula: C17H26N2 MolecularWeight: 258.40174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2/c1-13(2)11-17(12-14(3)4)19-16-7-5-15(6-8-16)9-10-18/h5-8,13-14,17,19H,9,11-12H2,1-4H3