(3-methyl-2-oxidanylidene-pentyl) 2,4,6-trimethylbenzenesulfonate

Systemtic Name: (3-methyl-2-oxidanylidene-pentyl) 2,4,6-trimethylbenzenesulfonate Openeye Name: (3-methyl-2-oxo-pentyl) 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid (3-methyl-2-oxopentyl) ester IUPAC Name: (3-methyl-2-oxopentyl) 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid (2-keto-3-methyl-pentyl) ester Formula: C15H22O4S MolecularWeight: 298.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)COS(=O)(=O)C1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCC(C)C(=O)COS(=O)(=O)C1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C15H22O4S/c1-6-11(3)14(16)9-19-20(17,18)15-12(4)7-10(2)8-13(15)5/h7-8,11H,6,9H2,1-5H3