2-[methyl(phenylsulfonyl)amino]hexanoic acid

Systemtic Name: 2-[methyl(phenylsulfonyl)amino]hexanoic acid Openeye Name: 2-[benzenesulfonyl(methyl)amino]hexanoic acid CAS Name: 2-[benzenesulfonyl(methyl)amino]hexanoic acid IUPAC Name: 2-[benzenesulfonyl(methyl)amino]hexanoic acid Traditional Name: 2-[besyl(methyl)amino]hexanoic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)N(C)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC(C(=O)O)N(C)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H19NO4S/c1-3-4-10-12(13(15)16)14(2)19(17,18)11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3,(H,15,16)