[2-oxidanylidene-2-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]ethyl]azanium

Systemtic Name: [2-oxidanylidene-2-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]ethyl]azanium Openeye Name: [2-oxo-2-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]ethyl]ammonium CAS Name: [2-oxo-2-[4-[(1S)-1-phenylethyl]-1-piperazin-4-iumyl]ethyl]ammonium IUPAC Name: [2-oxo-2-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]ethyl]azanium Traditional Name: [2-keto-2-[4-[(1S)-1-phenylethyl]piperazin-4-ium-1-yl]ethyl]ammonium Formula: C14H23N3O+2 MolecularWeight: 249.35192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CCN(CC2)C(=O)C[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+]2CCN(CC2)C(=O)C[NH3+]

InChI

InChI=1S/C14H21N3O/c1-12(13-5-3-2-4-6-13)16-7-9-17(10-8-16)14(18)11-15/h2-6,12H,7-11,15H2,1H3/p+2/t12-/m0/s1