1-[4-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[(2S)-2-oxidanyl-2-phenyl-ethyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[(2S)-2-hydroxy-2-phenyl-ethyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[(2S)-2-hydroxy-2-phenylethyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[(2S)-2-hydroxy-2-phenylethyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[(2S)-2-hydroxy-2-phenyl-ethyl]piperazin-4-ium-1-yl]ethanone Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(C2=CC=CC=C2)O

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)C[C@H](C2=CC=CC=C2)O

InChI

InChI=1S/C14H20N2O2/c1-12(17)16-9-7-15(8-10-16)11-14(18)13-5-3-2-4-6-13/h2-6,14,18H,7-11H2,1H3/p+1/t14-/m1/s1