2-(2-methylheptan-2-yl)-6-oxidanyl-benzenesulfonate

Systemtic Name: 2-(2-methylheptan-2-yl)-6-oxidanyl-benzenesulfonate Openeye Name: 2-(1,1-dimethylhexyl)-6-hydroxy-benzenesulfonate CAS Name: 2-hydroxy-6-(2-methylheptan-2-yl)benzenesulfonate IUPAC Name: 2-hydroxy-6-(2-methylheptan-2-yl)benzenesulfonate Traditional Name: 2-(1,1-dimethylhexyl)-6-hydroxy-besylate Formula: C14H21O4S- MolecularWeight: 285.37914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=C(C(=CC=C1)O)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCC(C)(C)C1=C(C(=CC=C1)O)S(=O)(=O)[O-]

InChI

InChI=1S/C14H22O4S/c1-4-5-6-10-14(2,3)11-8-7-9-12(15)13(11)19(16,17)18/h7-9,15H,4-6,10H2,1-3H3,(H,16,17,18)/p-1