[(2S)-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-[4-(4-fluorobenzoyl)piperazin-1-yl]-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-[4-(4-fluorobenzoyl)piperazino]-2-hydroxy-propyl]ammonium Formula: C14H21FN3O2+ MolecularWeight: 282.333843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C[NH3+])O)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

C1CN(CCN1C[C@H](C[NH3+])O)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C14H20FN3O2/c15-12-3-1-11(2-4-12)14(20)18-7-5-17(6-8-18)10-13(19)9-16/h1-4,13,19H,5-10,16H2/p+1/t13-/m0/s1