2-oxidanylidenepentyl 3,4,5-trimethylbenzenesulfonate

Systemtic Name: 2-oxidanylidenepentyl 3,4,5-trimethylbenzenesulfonate Openeye Name: 2-oxopentyl 3,4,5-trimethylbenzenesulfonate CAS Name: 3,4,5-trimethylbenzenesulfonic acid 2-oxopentyl ester IUPAC Name: 2-oxopentyl 3,4,5-trimethylbenzenesulfonate Traditional Name: 3,4,5-trimethylbenzenesulfonic acid 2-ketopentyl ester Formula: C14H20O4S MolecularWeight: 284.3712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O4S/c1-5-6-13(15)9-18-19(16,17)14-7-10(2)12(4)11(3)8-14/h7-8H,5-6,9H2,1-4H3