2-[3-[1-(4-methylphenyl)propylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[1-(4-methylphenyl)propylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[1-(p-tolyl)propylamino]phenoxy]acetonitrile CAS Name: 2-[3-[1-(4-methylphenyl)propylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[1-(4-methylphenyl)propylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[1-(p-tolyl)propylamino]phenoxy]acetonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC2=CC(=CC=C2)OCC#N

InChI

InChI=1S/C18H20N2O/c1-3-18(15-9-7-14(2)8-10-15)20-16-5-4-6-17(13-16)21-12-11-19/h4-10,13,18,20H,3,12H2,1-2H3