3-(4-nitrophenyl)sulfonylbutanoic acid

Systemtic Name: 3-(4-nitrophenyl)sulfonylbutanoic acid Openeye Name: 3-(4-nitrophenyl)sulfonylbutanoic acid CAS Name: 3-(4-nitrophenyl)sulfonylbutanoic acid IUPAC Name: 3-(4-nitrophenyl)sulfonylbutanoic acid Traditional Name: 3-nosylbutyric acid Formula: C10H11NO6S MolecularWeight: 273.26244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO6S/c1-7(6-10(12)13)18(16,17)9-4-2-8(3-5-9)11(14)15/h2-5,7H,6H2,1H3,(H,12,13)