1-oxidanylidene-1-phenoxy-octane-2-sulfonic acid

Systemtic Name: 1-oxidanylidene-1-phenoxy-octane-2-sulfonic acid Openeye Name: 1-oxo-1-phenoxy-octane-2-sulfonic acid CAS Name: 1-oxo-1-phenoxy-2-octanesulfonic acid IUPAC Name: 1-oxo-1-phenoxyoctane-2-sulfonic acid Traditional Name: 1-keto-1-phenoxy-octane-2-sulfonic acid Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O5S/c1-2-3-4-8-11-13(20(16,17)18)14(15)19-12-9-6-5-7-10-12/h5-7,9-10,13H,2-4,8,11H2,1H3,(H,16,17,18)