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

Systemtic Name: 1-[2-(2-methylphenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-[2-(2-methylphenoxy)ethyl]piperazine-1,4-diium CAS Name: 1-[2-(2-methylphenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-[2-(2-methylphenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(2-methylphenoxy)ethyl]piperazine-1,4-diium Formula: C13H22N2O+2 MolecularWeight: 222.32658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC[NH+]2CC[NH2+]CC2

Isomeric SMILES

CC1=CC=CC=C1OCC[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C13H20N2O/c1-12-4-2-3-5-13(12)16-11-10-15-8-6-14-7-9-15/h2-5,14H,6-11H2,1H3/p+2