2-(4-nitrophenyl)sulfonylpropanoate

Systemtic Name: 2-(4-nitrophenyl)sulfonylpropanoate Openeye Name: 2-(4-nitrophenyl)sulfonylpropanoate CAS Name: 2-(4-nitrophenyl)sulfonylpropanoate IUPAC Name: 2-(4-nitrophenyl)sulfonylpropanoate Traditional Name: 2-nosylpropionate Formula: C9H8NO6S- MolecularWeight: 258.22792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO6S/c1-6(9(11)12)17(15,16)8-4-2-7(3-5-8)10(13)14/h2-6H,1H3,(H,11,12)/p-1