2-[(3R)-1-phenethylpiperidin-3-yl]-2,2-diphenyl-ethanenitrile

Systemtic Name: 2-[(3R)-1-phenethylpiperidin-3-yl]-2,2-diphenyl-ethanenitrile Openeye Name: 2-[(3R)-1-phenethyl-3-piperidyl]-2,2-diphenyl-acetonitrile CAS Name: 2-[(3R)-1-phenethyl-3-piperidinyl]-2,2-diphenylacetonitrile IUPAC Name: 2-[(3R)-1-phenethylpiperidin-3-yl]-2,2-diphenylacetonitrile Traditional Name: 2-[(3R)-1-phenethyl-3-piperidyl]-2,2-diphenyl-acetonitrile Formula: C27H28N2 MolecularWeight: 380.52462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CC=CC=C2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)CCC2=CC=CC=C2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2/c28-22-27(24-13-6-2-7-14-24,25-15-8-3-9-16-25)26-17-10-19-29(21-26)20-18-23-11-4-1-5-12-23/h1-9,11-16,26H,10,17-21H2/t26-/m0/s1