(2S,3S)-3-azanyl-3-(2-nitrophenyl)-2-oxidanyl-propanoic acid

Systemtic Name: (2S,3S)-3-azanyl-3-(2-nitrophenyl)-2-oxidanyl-propanoic acid Openeye Name: (2S,3S)-3-amino-2-hydroxy-3-(2-nitrophenyl)propanoic acid CAS Name: (2S,3S)-3-amino-2-hydroxy-3-(2-nitrophenyl)propanoic acid IUPAC Name: (2S,3S)-3-amino-2-hydroxy-3-(2-nitrophenyl)propanoic acid Traditional Name: (2S,3S)-3-amino-2-hydroxy-3-(2-nitrophenyl)propionic acid Formula: C9H10N2O5 MolecularWeight: 226.1861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(C(=O)O)O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[C@@H]([C@@H](C(=O)O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C9H10N2O5/c10-7(8(12)9(13)14)5-3-1-2-4-6(5)11(15)16/h1-4,7-8,12H,10H2,(H,13,14)/t7-,8-/m0/s1