1-[(4-hexoxyphenyl)methyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[(4-hexoxyphenyl)methyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[(4-hexoxyphenyl)methyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[(4-hexoxyphenyl)methyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[(4-hexoxyphenyl)methyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-(4-hexoxybenzyl)-4-methyl-piperazine-1,4-diium Formula: C18H32N2O+2 MolecularWeight: 292.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C18H30N2O/c1-3-4-5-6-15-21-18-9-7-17(8-10-18)16-20-13-11-19(2)12-14-20/h7-10H,3-6,11-16H2,1-2H3/p+2