2-[(5-chloranyl-2-cyano-phenyl)sulfonylamino]hexanoic acid

Systemtic Name: 2-[(5-chloranyl-2-cyano-phenyl)sulfonylamino]hexanoic acid Openeye Name: 2-[(5-chloro-2-cyano-phenyl)sulfonylamino]hexanoic acid CAS Name: 2-[(5-chloro-2-cyanophenyl)sulfonylamino]hexanoic acid IUPAC Name: 2-[(5-chloro-2-cyanophenyl)sulfonylamino]hexanoic acid Traditional Name: 2-[(5-chloro-2-cyano-phenyl)sulfonylamino]hexanoic acid Formula: C13H15ClN2O4S MolecularWeight: 330.7872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Cl)C#N

Isomeric SMILES

CCCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)Cl)C#N

InChI

InChI=1S/C13H15ClN2O4S/c1-2-3-4-11(13(17)18)16-21(19,20)12-7-10(14)6-5-9(12)8-15/h5-7,11,16H,2-4H2,1H3,(H,17,18)