[(2S)-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-[methyl-[2-(4-pyridyl)ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-[methyl(2-pyridin-4-ylethyl)amino]-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-keto-2-[methyl-[2-(4-pyridyl)ethyl]amino]ethyl]ammonium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=NC=C1)C(=O)C(CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CN(CCC1=CC=NC=C1)C(=O)[C@H](CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C17H21N3O/c1-20(12-9-14-7-10-19-11-8-14)17(21)16(18)13-15-5-3-2-4-6-15/h2-8,10-11,16H,9,12-13,18H2,1H3/p+1/t16-/m0/s1