2-[4-[[1-(diphenylmethyl)azetidin-3-yl]amino]piperidin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[[1-(diphenylmethyl)azetidin-3-yl]amino]piperidin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(1-benzhydrylazetidin-3-yl)amino]-1-piperidyl]benzonitrile CAS Name: 2-[4-[[1-(diphenylmethyl)-3-azetidinyl]amino]-1-piperidinyl]benzonitrile IUPAC Name: 2-[4-[(1-benzhydrylazetidin-3-yl)amino]piperidin-1-yl]benzonitrile Traditional Name: 2-[4-[(1-benzhydrylazetidin-3-yl)amino]piperidino]benzonitrile Formula: C28H30N4 MolecularWeight: 422.5646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5C#N

Isomeric SMILES

C1CN(CCC1NC2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5C#N

InChI

InChI=1S/C28H30N4/c29-19-24-13-7-8-14-27(24)31-17-15-25(16-18-31)30-26-20-32(21-26)28(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-14,25-26,28,30H,15-18,20-21H2