[(2S)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(2-chloranyl-6-fluoranyl-phenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(2-chloro-6-fluoro-phenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(2-chloro-6-fluorophenyl)-2-(4-propyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(2-chloro-6-fluorophenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(2-chloro-6-fluoro-phenyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C15H25ClFN3+2 MolecularWeight: 301.830503

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(C[NH3+])C2=C(C=CC=C2Cl)F

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@H](C[NH3+])C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C15H23ClFN3/c1-2-6-19-7-9-20(10-8-19)14(11-18)15-12(16)4-3-5-13(15)17/h3-5,14H,2,6-11,18H2,1H3/p+2/t14-/m1/s1