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

Systemtic Name: 1-[2-(4-butoxyphenoxy)ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-(4-butoxyphenoxy)ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-(4-butoxyphenoxy)ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-(4-butoxyphenoxy)ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-(4-butoxyphenoxy)ethyl]-4-methyl-piperazine-1,4-diium Formula: C17H30N2O2+2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C17H28N2O2/c1-3-4-14-20-16-5-7-17(8-6-16)21-15-13-19-11-9-18(2)10-12-19/h5-8H,3-4,9-15H2,1-2H3/p+2