1-[(4-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1,4-diium Openeye Name: 1-[(4-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1,4-diium CAS Name: 1-[(4-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-[(4-ethoxyphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(4-ethoxybenzyl)-4-(4-fluorobenzyl)piperazine-1,4-diium Formula: C20H27FN2O+2 MolecularWeight: 330.439583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H25FN2O/c1-2-24-20-9-5-18(6-10-20)16-23-13-11-22(12-14-23)15-17-3-7-19(21)8-4-17/h3-10H,2,11-16H2,1H3/p+2