(2S)-2-[(3-nitrophenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[(3-nitrophenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-3-hydroxy-2-[(3-nitrobenzoyl)amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[(3-nitrophenyl)-oxomethyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[(3-nitrobenzoyl)amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(3-nitrobenzoyl)amino]propionate Formula: C10H9N2O6- MolecularWeight: 253.18826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O6/c13-5-8(10(15)16)11-9(14)6-2-1-3-7(4-6)12(17)18/h1-4,8,13H,5H2,(H,11,14)(H,15,16)/p-1/t8-/m0/s1