3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-1-ol

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-1-ol Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-1-ol CAS Name: 3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-1-propanol IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-1-ol Traditional Name: 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propan-1-ol Formula: C13H20ClN2O+ MolecularWeight: 255.7637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCO)C2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCO)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H19ClN2O/c14-12-3-1-4-13(11-12)16-8-6-15(7-9-16)5-2-10-17/h1,3-4,11,17H,2,5-10H2/p+1