[(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[4-[(1S)-1-methylpropyl]piperazin-1-yl]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-[(2S)-butan-2-yl]-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-[(2S)-butan-2-yl]piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-[4-[(1S)-1-methylpropyl]piperazino]ethyl]ammonium Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC[C@H](C)N1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C17H27N3O/c1-3-14(2)19-9-11-20(12-10-19)17(21)16(18)13-15-7-5-4-6-8-15/h4-8,14,16H,3,9-13,18H2,1-2H3/p+1/t14-,16-/m0/s1