2-(1-chloranylhexoxycarbonyl)benzenesulfonic acid

Systemtic Name: 2-(1-chloranylhexoxycarbonyl)benzenesulfonic acid Openeye Name: 2-(1-chlorohexoxycarbonyl)benzenesulfonic acid CAS Name: 2-[1-chlorohexoxy(oxo)methyl]benzenesulfonic acid IUPAC Name: 2-(1-chlorohexoxycarbonyl)benzenesulfonic acid Traditional Name: 2-(1-chlorohexoxycarbonyl)besylic acid Formula: C13H17ClO5S MolecularWeight: 320.78908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(OC(=O)C1=CC=CC=C1S(=O)(=O)O)Cl

Isomeric SMILES

CCCCCC(OC(=O)C1=CC=CC=C1S(=O)(=O)O)Cl

InChI

InChI=1S/C13H17ClO5S/c1-2-3-4-9-12(14)19-13(15)10-7-5-6-8-11(10)20(16,17)18/h5-8,12H,2-4,9H2,1H3,(H,16,17,18)