(3-methyl-2-oxidanylidene-pentyl) 4-ethoxybenzenesulfonate

Systemtic Name: (3-methyl-2-oxidanylidene-pentyl) 4-ethoxybenzenesulfonate Openeye Name: (3-methyl-2-oxo-pentyl) 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid (3-methyl-2-oxopentyl) ester IUPAC Name: (3-methyl-2-oxopentyl) 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid (2-keto-3-methyl-pentyl) ester Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O5S/c1-4-11(3)14(15)10-19-20(16,17)13-8-6-12(7-9-13)18-5-2/h6-9,11H,4-5,10H2,1-3H3