(2S)-2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoate Openeye Name: (2S)-3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(4-nitrobenzyl)sulfonylamino]propionate Formula: C10H11N2O7S- MolecularWeight: 303.26854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)NC(CO)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)N[C@@H](CO)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O7S/c13-5-9(10(14)15)11-20(18,19)6-7-1-3-8(4-2-7)12(16)17/h1-4,9,11,13H,5-6H2,(H,14,15)/p-1/t9-/m0/s1