1-methyl-4-[2-(4-propan-2-yloxyphenoxy)ethyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[2-(4-propan-2-yloxyphenoxy)ethyl]piperazine-1,4-diium Openeye Name: 1-[2-(4-isopropoxyphenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-methyl-4-[2-(4-propan-2-yloxyphenoxy)ethyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[2-(4-propan-2-yloxyphenoxy)ethyl]piperazine-1,4-diium Traditional Name: 1-[2-(4-isopropoxyphenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C16H28N2O2+2 MolecularWeight: 280.40572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C16H26N2O2/c1-14(2)20-16-6-4-15(5-7-16)19-13-12-18-10-8-17(3)9-11-18/h4-7,14H,8-13H2,1-3H3/p+2