2-oxidanylideneoctyl 2,4,6-trimethylbenzenesulfonate

Systemtic Name: 2-oxidanylideneoctyl 2,4,6-trimethylbenzenesulfonate Openeye Name: 2-oxooctyl 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid 2-oxooctyl ester IUPAC Name: 2-oxooctyl 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid 2-ketooctyl ester Formula: C17H26O4S MolecularWeight: 326.45094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O4S/c1-5-6-7-8-9-16(18)12-21-22(19,20)17-14(3)10-13(2)11-15(17)4/h10-11H,5-9,12H2,1-4H3