1-(3-bromanylphenoxy)-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(3-bromanylphenoxy)-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol Openeye Name: 1-(3-bromophenoxy)-3-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propan-2-ol CAS Name: 1-(3-bromophenoxy)-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-propanol IUPAC Name: 1-(3-bromophenoxy)-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propan-2-ol Traditional Name: 1-(3-bromophenoxy)-3-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propan-2-ol Formula: C19H21BrF3N3O2 MolecularWeight: 460.28815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC(=CC=C2)Br)O)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(COC2=CC(=CC=C2)Br)O)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H21BrF3N3O2/c20-15-2-1-3-17(10-15)28-13-16(27)12-25-6-8-26(9-7-25)18-5-4-14(11-24-18)19(21,22)23/h1-5,10-11,16,27H,6-9,12-13H2