[(2S)-1-(butylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-(butylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-(butylamino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(butylamino)-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-(butylamino)-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-(butylamino)-2-keto-ethyl]ammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CCCCNC(=O)[C@H](CC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C13H20N2O/c1-2-3-9-15-13(16)12(14)10-11-7-5-4-6-8-11/h4-8,12H,2-3,9-10,14H2,1H3,(H,15,16)/p+1/t12-/m0/s1