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

Systemtic Name: (3-ethyl-2-oxidanylidene-heptyl) 4-ethoxybenzenesulfonate Openeye Name: (3-ethyl-2-oxo-heptyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (3-ethyl-2-oxoheptyl) ester IUPAC Name: (3-ethyl-2-oxoheptyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (3-ethyl-2-keto-heptyl) ester Formula: C17H26O5S MolecularWeight: 342.45034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O5S/c1-4-7-8-14(5-2)17(18)13-22-23(19,20)16-11-9-15(10-12-16)21-6-3/h9-12,14H,4-8,13H2,1-3H3