[3-[[[(2S)-2-acetamido-2-phenyl-ethanoyl]amino]methyl]phenyl]methylazanium chloride

Systemtic Name: [3-[[[(2S)-2-acetamido-2-phenyl-ethanoyl]amino]methyl]phenyl]methylazanium chloride Openeye Name: [3-[[[(2S)-2-acetamido-2-phenyl-acetyl]amino]methyl]phenyl]methylammonium chloride CAS Name: [3-[[[(2S)-2-acetamido-1-oxo-2-phenylethyl]amino]methyl]phenyl]methylammonium chloride IUPAC Name: [3-[[[(2S)-2-acetamido-2-phenylacetyl]amino]methyl]phenyl]methylazanium chloride Traditional Name: [3-[[[(2S)-2-acetamido-2-phenyl-acetyl]amino]methyl]benzyl]ammonium chloride Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CC=CC=C1)C(=O)NCC2=CC(=CC=C2)C[NH3+].[Cl-]

Isomeric SMILES

CC(=O)N[C@@H](C1=CC=CC=C1)C(=O)NCC2=CC(=CC=C2)C[NH3+].[Cl-]

InChI

InChI=1S/C18H21N3O2.ClH/c1-13(22)21-17(16-8-3-2-4-9-16)18(23)20-12-15-7-5-6-14(10-15)11-19;/h2-10,17H,11-12,19H2,1H3,(H,20,23)(H,21,22);1H/t17-;/m0./s1