4-octanoyloxybenzenesulfonic acid

Systemtic Name: 4-octanoyloxybenzenesulfonic acid Openeye Name: 4-octanoyloxybenzenesulfonic acid CAS Name: 4-(1-oxooctoxy)benzenesulfonic acid IUPAC Name: 4-octanoyloxybenzenesulfonic acid Traditional Name: 4-caprylyloxybesylic acid Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C14H20O5S/c1-2-3-4-5-6-7-14(15)19-12-8-10-13(11-9-12)20(16,17)18/h8-11H,2-7H2,1H3,(H,16,17,18)