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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)OCC=C

Isomeric SMILES

CN1CC[NH+](CC1)CCCCOC2=CC=C(C=C2)OCC=C

InChI

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