1-methyl-4-[4-(2-prop-2-enoxyphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-methyl-4-[4-(2-prop-2-enoxyphenoxy)butyl]piperazin-4-ium Openeye Name: 1-[4-(2-allyloxyphenoxy)butyl]-4-methyl-piperazin-1-ium CAS Name: 1-methyl-4-[4-(2-prop-2-enoxyphenoxy)butyl]piperazin-4-ium IUPAC Name: 1-methyl-4-[4-(2-prop-2-enoxyphenoxy)butyl]piperazin-4-ium Traditional Name: 1-[4-(2-allyloxyphenoxy)butyl]-4-methyl-piperazin-1-ium Formula: C18H29N2O2+ MolecularWeight: 305.43506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CCCCOC2=CC=CC=C2OCC=C

Isomeric SMILES

CN1CC[NH+](CC1)CCCCOC2=CC=CC=C2OCC=C

InChI

InChI=1S/C18H28N2O2/c1-3-15-21-17-8-4-5-9-18(17)22-16-7-6-10-20-13-11-19(2)12-14-20/h3-5,8-9H,1,6-7,10-16H2,2H3/p+1