[(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-oxidanylidene-2-piperazin-1-yl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-oxidanylidene-2-piperazin-1-yl-ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(2-chloro-6-fluoro-phenyl)-2-oxo-2-piperazin-1-yl-ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(2-chloro-6-fluorophenyl)-2-oxo-2-(1-piperazinyl)ethyl]-diethylammonium IUPAC Name: [(1S)-1-(2-chloro-6-fluorophenyl)-2-oxo-2-piperazin-1-ylethyl]-diethylazanium Traditional Name: [(1S)-1-(2-chloro-6-fluoro-phenyl)-2-keto-2-piperazino-ethyl]-diethyl-ammonium Formula: C16H24ClFN3O+ MolecularWeight: 328.832663

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C1=C(C=CC=C1Cl)F)C(=O)N2CCNCC2

Isomeric SMILES

CC[NH+](CC)[C@@H](C1=C(C=CC=C1Cl)F)C(=O)N2CCNCC2

InChI

InChI=1S/C16H23ClFN3O/c1-3-20(4-2)15(14-12(17)6-5-7-13(14)18)16(22)21-10-8-19-9-11-21/h5-7,15,19H,3-4,8-11H2,1-2H3/p+1/t15-/m0/s1