2-acetyloxybenzenesulfonic acid; 5-pentyloxolan-2-one

Systemtic Name: 2-acetyloxybenzenesulfonic acid; 5-pentyloxolan-2-one Openeye Name: 2-acetoxybenzenesulfonic acid; 5-pentyltetrahydrofuran-2-one CAS Name: 2-acetyloxybenzenesulfonic acid; 5-pentyl-2-oxolanone IUPAC Name: 2-acetyloxybenzenesulfonic acid; 5-pentyloxolan-2-one Traditional Name: 2-acetoxybesylic acid; 5-amyltetrahydrofuran-2-one Formula: C17H24O7S MolecularWeight: 372.43326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(=O)O1.CC(=O)OC1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CCCCCC1CCC(=O)O1.CC(=O)OC1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C9H16O2.C8H8O5S/c1-2-3-4-5-8-6-7-9(10)11-8;1-6(9)13-7-4-2-3-5-8(7)14(10,11)12/h8H,2-7H2,1H3;2-5H,1H3,(H,10,11,12)