2-[4-(3-methylpentan-2-ylamino)phenyl]ethanenitrile

Systemtic Name: 2-[4-(3-methylpentan-2-ylamino)phenyl]ethanenitrile Openeye Name: 2-[4-(1,2-dimethylbutylamino)phenyl]acetonitrile CAS Name: 2-[4-(3-methylpentan-2-ylamino)phenyl]acetonitrile IUPAC Name: 2-[4-(3-methylpentan-2-ylamino)phenyl]acetonitrile Traditional Name: 2-[4-(1,2-dimethylbutylamino)phenyl]acetonitrile Formula: C14H20N2 MolecularWeight: 216.322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2/c1-4-11(2)12(3)16-14-7-5-13(6-8-14)9-10-15/h5-8,11-12,16H,4,9H2,1-3H3