2-methyl-6-[methyl(phenylsulfonyl)amino]hexanoic acid

Systemtic Name: 2-methyl-6-[methyl(phenylsulfonyl)amino]hexanoic acid Openeye Name: 6-[benzenesulfonyl(methyl)amino]-2-methyl-hexanoic acid CAS Name: 6-[benzenesulfonyl(methyl)amino]-2-methylhexanoic acid IUPAC Name: 6-[benzenesulfonyl(methyl)amino]-2-methylhexanoic acid Traditional Name: 6-[besyl(methyl)amino]-2-methyl-hexanoic acid Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN(C)S(=O)(=O)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CCCCN(C)S(=O)(=O)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H21NO4S/c1-12(14(16)17)8-6-7-11-15(2)20(18,19)13-9-4-3-5-10-13/h3-5,9-10,12H,6-8,11H2,1-2H3,(H,16,17)