1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium

Systemtic Name: 1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium Openeye Name: 1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium CAS Name: 1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium IUPAC Name: 1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium Traditional Name: 1-[6-(2-methylphenoxy)hexyl]piperazine-1,4-diium Formula: C17H30N2O+2 MolecularWeight: 278.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCCCC[NH+]2CC[NH2+]CC2

Isomeric SMILES

CC1=CC=CC=C1OCCCCCC[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C17H28N2O/c1-16-8-4-5-9-17(16)20-15-7-3-2-6-12-19-13-10-18-11-14-19/h4-5,8-9,18H,2-3,6-7,10-15H2,1H3/p+2