[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-2-keto-1-methylol-ethyl]ammonium Formula: C12H18N3O3+ MolecularWeight: 252.28962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)C(CO)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)[C@H](CO)[NH3+]

InChI

InChI=1S/C12H17N3O3/c13-9(7-16)12(18)15-10(11(14)17)6-8-4-2-1-3-5-8/h1-5,9-10,16H,6-7,13H2,(H2,14,17)(H,15,18)/p+1/t9-,10-/m0/s1