2-dodecan-5-ylbenzenesulfonic acid

Systemtic Name: 2-dodecan-5-ylbenzenesulfonic acid Openeye Name: 2-(1-butyloctyl)benzenesulfonic acid CAS Name: 2-dodecan-5-ylbenzenesulfonic acid IUPAC Name: 2-dodecan-5-ylbenzenesulfonic acid Traditional Name: 2-(1-butyloctyl)besylic acid Formula: C18H30O3S MolecularWeight: 326.494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCC)C1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CCCCCCCC(CCCC)C1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C18H30O3S/c1-3-5-7-8-9-13-16(12-6-4-2)17-14-10-11-15-18(17)22(19,20)21/h10-11,14-16H,3-9,12-13H2,1-2H3,(H,19,20,21)