1-[3-(4-butoxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[3-(4-butoxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[3-(4-butoxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[3-(4-butoxyphenoxy)propyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[3-(4-butoxyphenoxy)propyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[3-(4-butoxyphenoxy)propyl]-4-methyl-piperazine-1,4-diium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2O2/c1-3-4-15-21-17-6-8-18(9-7-17)22-16-5-10-20-13-11-19(2)12-14-20/h6-9H,3-5,10-16H2,1-2H3/p+2