2-[(3-cyanophenyl)methylsulfonylamino]hexanoic acid

Systemtic Name: 2-[(3-cyanophenyl)methylsulfonylamino]hexanoic acid Openeye Name: 2-[(3-cyanophenyl)methylsulfonylamino]hexanoic acid CAS Name: 2-[(3-cyanophenyl)methylsulfonylamino]hexanoic acid IUPAC Name: 2-[(3-cyanophenyl)methylsulfonylamino]hexanoic acid Traditional Name: 2-[(3-cyanobenzyl)sulfonylamino]hexanoic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C#N

Isomeric SMILES

CCCCC(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H18N2O4S/c1-2-3-7-13(14(17)18)16-21(19,20)10-12-6-4-5-11(8-12)9-15/h4-6,8,13,16H,2-3,7,10H2,1H3,(H,17,18)