4-methyl-3-octyl-benzenesulfonic acid

Systemtic Name: 4-methyl-3-octyl-benzenesulfonic acid Openeye Name: 4-methyl-3-octyl-benzenesulfonic acid CAS Name: 4-methyl-3-octylbenzenesulfonic acid IUPAC Name: 4-methyl-3-octylbenzenesulfonic acid Traditional Name: 4-methyl-3-octyl-besylic acid Formula: C15H24O3S MolecularWeight: 284.41426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC(=C1)S(=O)(=O)O)C

Isomeric SMILES

CCCCCCCCC1=C(C=CC(=C1)S(=O)(=O)O)C

InChI

InChI=1S/C15H24O3S/c1-3-4-5-6-7-8-9-14-12-15(19(16,17)18)11-10-13(14)2/h10-12H,3-9H2,1-2H3,(H,16,17,18)