1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(phenylmethyl)piperidine-4-carbonitrile

Systemtic Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(phenylmethyl)piperidine-4-carbonitrile Openeye Name: 4-benzyl-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperidine-4-carbonitrile CAS Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(phenylmethyl)-4-piperidinecarbonitrile IUPAC Name: 4-benzyl-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]piperidine-4-carbonitrile Traditional Name: 4-benzyl-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]isonipecotonitrile Formula: C28H28F2N2O MolecularWeight: 446.531526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC2=CC=CC=C2)C#N)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1(CC2=CC=CC=C2)C#N)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H28F2N2O/c29-25-10-6-23(7-11-25)27(24-8-12-26(30)13-9-24)33-19-18-32-16-14-28(21-31,15-17-32)20-22-4-2-1-3-5-22/h1-13,27H,14-20H2