2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid Openeye Name: 2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]hexanoic acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)C)C

Isomeric SMILES

CCCCC(C(=O)O)NS(=O)(=O)C1=C(C=CC(=C1)C)C

InChI

InChI=1S/C14H21NO4S/c1-4-5-6-12(14(16)17)15-20(18,19)13-9-10(2)7-8-11(13)3/h7-9,12,15H,4-6H2,1-3H3,(H,16,17)