1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)piperazin-1-ium

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)piperazin-1-ium Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)piperazin-1-ium CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)piperazin-1-ium IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-fluorophenyl)piperazin-1-ium Traditional Name: 1-(4-fluorophenyl)-4-homoveratryl-piperazin-4-ium Formula: C20H26FN2O2+ MolecularWeight: 345.431043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H25FN2O2/c1-24-19-8-3-16(15-20(19)25-2)9-10-22-11-13-23(14-12-22)18-6-4-17(21)5-7-18/h3-8,15H,9-14H2,1-2H3/p+1