[(2S)-2-[(4-fluorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(2S)-2-[(4-fluorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(2S)-2-[(4-fluorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(2S)-2-[(4-fluorophenyl)methyl]-3-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(2S)-2-[(4-fluorophenyl)methyl]-3-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(2S)-2-(4-fluorobenzyl)-3-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C15H26FN3+2 MolecularWeight: 267.385443

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(CC2=CC=C(C=C2)F)C[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@@H](CC2=CC=C(C=C2)F)C[NH3+]

InChI

InChI=1S/C15H24FN3/c1-18-6-8-19(9-7-18)12-14(11-17)10-13-2-4-15(16)5-3-13/h2-5,14H,6-12,17H2,1H3/p+2/t14-/m0/s1