3-(4-nitrophenyl)sulfonylpropanoic acid

Systemtic Name: 3-(4-nitrophenyl)sulfonylpropanoic acid Openeye Name: 3-(4-nitrophenyl)sulfonylpropanoic acid CAS Name: 3-(4-nitrophenyl)sulfonylpropanoic acid IUPAC Name: 3-(4-nitrophenyl)sulfonylpropanoic acid Traditional Name: 3-nosylpropionic acid Formula: C9H9NO6S MolecularWeight: 259.23586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO6S/c11-9(12)5-6-17(15,16)8-3-1-7(2-4-8)10(13)14/h1-4H,5-6H2,(H,11,12)