2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanesulfonic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanesulfonic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanesulfonic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)ethanesulfonic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)ethanesulfonic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanesulfonic acid Formula: C16H26O4S MolecularWeight: 314.44024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCS(=O)(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCS(=O)(=O)O

InChI

InChI=1S/C16H26O4S/c1-15(2,3)12-9-11(7-8-21(18,19)20)10-13(14(12)17)16(4,5)6/h9-10,17H,7-8H2,1-6H3,(H,18,19,20)