(2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]pyrrolidin-1-ium-2-carboxamide Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N

Isomeric SMILES

C1C[C@H]([NH2+]C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C14H19N3O2/c15-13(18)12(9-10-5-2-1-3-6-10)17-14(19)11-7-4-8-16-11/h1-3,5-6,11-12,16H,4,7-9H2,(H2,15,18)(H,17,19)/p+1/t11-,12-/m0/s1