2-oxidanylideneheptyl benzenesulfonate

Systemtic Name: 2-oxidanylideneheptyl benzenesulfonate Openeye Name: 2-oxoheptyl benzenesulfonate CAS Name: benzenesulfonic acid 2-oxoheptyl ester IUPAC Name: 2-oxoheptyl benzenesulfonate Traditional Name: benzenesulfonic acid 2-ketoheptyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCC(=O)COS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H18O4S/c1-2-3-5-8-12(14)11-17-18(15,16)13-9-6-4-7-10-13/h4,6-7,9-10H,2-3,5,8,11H2,1H3