2-butyl-5-oxidanyl-benzenesulfonic acid

Systemtic Name: 2-butyl-5-oxidanyl-benzenesulfonic acid Openeye Name: 2-butyl-5-hydroxy-benzenesulfonic acid CAS Name: 2-butyl-5-hydroxybenzenesulfonic acid IUPAC Name: 2-butyl-5-hydroxybenzenesulfonic acid Traditional Name: 2-butyl-5-hydroxy-besylic acid Formula: C10H14O4S MolecularWeight: 230.28076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)O)S(=O)(=O)O

Isomeric SMILES

CCCCC1=C(C=C(C=C1)O)S(=O)(=O)O

InChI

InChI=1S/C10H14O4S/c1-2-3-4-8-5-6-9(11)7-10(8)15(12,13)14/h5-7,11H,2-4H2,1H3,(H,12,13,14)