2-[(3-nitrophenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(3-nitrophenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(3-nitrophenyl)sulfonylamino]butanoic acid CAS Name: 2-[(3-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(3-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(3-nitrophenyl)sulfonylamino]butyric acid Formula: C10H12N2O6S MolecularWeight: 288.27708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O6S/c1-2-9(10(13)14)11-19(17,18)8-5-3-4-7(6-8)12(15)16/h3-6,9,11H,2H2,1H3,(H,13,14)