2-oxidanylideneoctyl 2-methylbenzenesulfonate

Systemtic Name: 2-oxidanylideneoctyl 2-methylbenzenesulfonate Openeye Name: 2-oxooctyl 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid 2-oxooctyl ester IUPAC Name: 2-oxooctyl 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid 2-ketooctyl ester Formula: C15H22O4S MolecularWeight: 298.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1C

InChI

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