1-(4-nitrophenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride

Systemtic Name: 1-(4-nitrophenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Openeye Name: 1-(4-nitrophenoxy)-3-[4-(2-pyridyl)piperazin-1-yl]propan-2-ol dihydrochloride CAS Name: 1-(4-nitrophenoxy)-3-[4-(2-pyridinyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(4-nitrophenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-(4-nitrophenoxy)-3-[4-(2-pyridyl)piperazino]propan-2-ol dihydrochloride Formula: C18H24Cl2N4O4 MolecularWeight: 431.31356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=CC=N3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)[N+](=O)[O-])O)C3=CC=CC=N3.Cl.Cl

InChI

InChI=1S/C18H22N4O4.2ClH/c23-16(14-26-17-6-4-15(5-7-17)22(24)25)13-20-9-11-21(12-10-20)18-3-1-2-8-19-18;;/h1-8,16,23H,9-14H2;2*1H