[(2S)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-[(3S,5S)-3,5-dimethylpiperidino]-2-keto-ethyl]ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C(CC2=CC=CC=C2)[NH3+])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)[C@H](CC2=CC=CC=C2)[NH3+])C

InChI

InChI=1S/C16H24N2O/c1-12-8-13(2)11-18(10-12)16(19)15(17)9-14-6-4-3-5-7-14/h3-7,12-13,15H,8-11,17H2,1-2H3/p+1/t12-,13-,15-/m0/s1