2-[4-[2-(4-fluoranylphenoxy)-2-phenyl-ethyl]piperazin-1-yl]pyrimidine hydrochloride

Systemtic Name: 2-[4-[2-(4-fluoranylphenoxy)-2-phenyl-ethyl]piperazin-1-yl]pyrimidine hydrochloride Openeye Name: 2-[4-[2-(4-fluorophenoxy)-2-phenyl-ethyl]piperazin-1-yl]pyrimidine hydrochloride CAS Name: 2-[4-[2-(4-fluorophenoxy)-2-phenylethyl]-1-piperazinyl]pyrimidine hydrochloride IUPAC Name: 2-[4-[2-(4-fluorophenoxy)-2-phenylethyl]piperazin-1-yl]pyrimidine hydrochloride Traditional Name: 2-[4-[2-(4-fluorophenoxy)-2-phenyl-ethyl]piperazino]pyrimidine hydrochloride Formula: C22H24ClFN4O MolecularWeight: 414.903563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C2=CC=CC=C2)OC3=CC=C(C=C3)F)C4=NC=CC=N4.Cl

Isomeric SMILES

C1CN(CCN1CC(C2=CC=CC=C2)OC3=CC=C(C=C3)F)C4=NC=CC=N4.Cl

InChI

InChI=1S/C22H23FN4O.ClH/c23-19-7-9-20(10-8-19)28-21(18-5-2-1-3-6-18)17-26-13-15-27(16-14-26)22-24-11-4-12-25-22;/h1-12,21H,13-17H2;1H