1-methyl-4-[3-(4-prop-2-enoxyphenoxy)propyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[3-(4-prop-2-enoxyphenoxy)propyl]piperazin-1-ium Openeye Name: 1-[3-(4-allyloxyphenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-methyl-4-[3-(4-prop-2-enoxyphenoxy)propyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[3-(4-prop-2-enoxyphenoxy)propyl]piperazin-1-ium Traditional Name: 1-[3-(4-allyloxyphenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCOC2=CC=C(C=C2)OCC=C

Isomeric SMILES

C[NH+]1CCN(CC1)CCCOC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C17H26N2O2/c1-3-14-20-16-5-7-17(8-6-16)21-15-4-9-19-12-10-18(2)11-13-19/h3,5-8H,1,4,9-15H2,2H3/p+1