(3-ethyl-2-oxidanylidene-hexyl) 4-ethoxybenzenesulfonate

Systemtic Name: (3-ethyl-2-oxidanylidene-hexyl) 4-ethoxybenzenesulfonate Openeye Name: (3-ethyl-2-oxo-hexyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (3-ethyl-2-oxohexyl) ester IUPAC Name: (3-ethyl-2-oxohexyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (3-ethyl-2-keto-hexyl) ester Formula: C16H24O5S MolecularWeight: 328.42376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C(=O)COS(=O)(=O)C1=CC=C(C=C1)OCC

Isomeric SMILES

CCCC(CC)C(=O)COS(=O)(=O)C1=CC=C(C=C1)OCC

InChI

InChI=1S/C16H24O5S/c1-4-7-13(5-2)16(17)12-21-22(18,19)15-10-8-14(9-11-15)20-6-3/h8-11,13H,4-7,12H2,1-3H3