2-[naphthalen-1-yl(piperidin-1-yl)methyl]-2-phenyl-butanenitrile

Systemtic Name: 2-[naphthalen-1-yl(piperidin-1-yl)methyl]-2-phenyl-butanenitrile Openeye Name: 2-[1-naphthyl(1-piperidyl)methyl]-2-phenyl-butanenitrile CAS Name: 2-[1-naphthalenyl(1-piperidinyl)methyl]-2-phenylbutanenitrile IUPAC Name: 2-[naphthalen-1-yl(piperidin-1-yl)methyl]-2-phenylbutanenitrile Traditional Name: 2-[1-naphthyl(piperidino)methyl]-2-phenyl-butyronitrile Formula: C26H28N2 MolecularWeight: 368.51392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)(C1=CC=CC=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCCC4

Isomeric SMILES

CCC(C#N)(C1=CC=CC=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCCC4

InChI

InChI=1S/C26H28N2/c1-2-26(20-27,22-14-5-3-6-15-22)25(28-18-9-4-10-19-28)24-17-11-13-21-12-7-8-16-23(21)24/h3,5-8,11-17,25H,2,4,9-10,18-19H2,1H3