2-oxidanylideneoctyl 4-methylbenzenesulfonate

Systemtic Name: 2-oxidanylideneoctyl 4-methylbenzenesulfonate Openeye Name: 2-oxooctyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-oxooctyl ester IUPAC Name: 2-oxooctyl 4-methylbenzenesulfonate Traditional Name: 4-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=C(C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C15H22O4S/c1-3-4-5-6-7-14(16)12-19-20(17,18)15-10-8-13(2)9-11-15/h8-11H,3-7,12H2,1-2H3