1-[bis(4-fluorophenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazin-4-ium

Systemtic Name: 1-[bis(4-fluorophenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazin-4-ium Openeye Name: 1-[bis(4-fluorophenyl)methyl]-4-[2-(4-pyridyl)ethyl]piperazin-4-ium CAS Name: 1-[bis(4-fluorophenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazin-4-ium IUPAC Name: 1-[bis(4-fluorophenyl)methyl]-4-(2-pyridin-4-ylethyl)piperazin-4-ium Traditional Name: 1-[bis(4-fluorophenyl)methyl]-4-[2-(4-pyridyl)ethyl]piperazin-4-ium Formula: C24H26F2N3+ MolecularWeight: 394.480146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=NC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=NC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H25F2N3/c25-22-5-1-20(2-6-22)24(21-3-7-23(26)8-4-21)29-17-15-28(16-18-29)14-11-19-9-12-27-13-10-19/h1-10,12-13,24H,11,14-18H2/p+1