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

Systemtic Name: 2-[4-(5-methylheptan-3-ylamino)phenyl]ethanenitrile Openeye Name: 2-[4-[(1-ethyl-3-methyl-pentyl)amino]phenyl]acetonitrile CAS Name: 2-[4-(5-methylheptan-3-ylamino)phenyl]acetonitrile IUPAC Name: 2-[4-(5-methylheptan-3-ylamino)phenyl]acetonitrile Traditional Name: 2-[4-[(1-ethyl-3-methyl-pentyl)amino]phenyl]acetonitrile Formula: C16H24N2 MolecularWeight: 244.37516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2/c1-4-13(3)12-15(5-2)18-16-8-6-14(7-9-16)10-11-17/h6-9,13,15,18H,4-5,10,12H2,1-3H3