2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoic acid CAS Name: 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoic acid IUPAC Name: 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoic acid Traditional Name: 3-hydroxy-2-[(4-nitrobenzyl)sulfonylamino]propionic acid Formula: C10H12N2O7S MolecularWeight: 304.27648

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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)NC(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)