2-[(4-chloranyl-2-nitro-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(4-chloranyl-2-nitro-phenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(4-chloro-2-nitro-phenyl)sulfonylamino]butanoic acid CAS Name: 2-[(4-chloro-2-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(4-chloro-2-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(4-chloro-2-nitro-phenyl)sulfonylamino]butyric acid Formula: C10H11ClN2O6S MolecularWeight: 322.72214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClN2O6S/c1-2-7(10(14)15)12-20(18,19)9-4-3-6(11)5-8(9)13(16)17/h3-5,7,12H,2H2,1H3,(H,14,15)