2-hexanoyloxy-3,4,5-trimethyl-benzenesulfonate

Systemtic Name: 2-hexanoyloxy-3,4,5-trimethyl-benzenesulfonate Openeye Name: 2-hexanoyloxy-3,4,5-trimethyl-benzenesulfonate CAS Name: 3,4,5-trimethyl-2-(1-oxohexoxy)benzenesulfonate IUPAC Name: 2-hexanoyloxy-3,4,5-trimethylbenzenesulfonate Traditional Name: 2-caproyloxy-3,4,5-trimethyl-besylate Formula: C15H21O5S- MolecularWeight: 313.38924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(C=C(C(=C1C)C)C)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCC(=O)OC1=C(C=C(C(=C1C)C)C)S(=O)(=O)[O-]

InChI

InChI=1S/C15H22O5S/c1-5-6-7-8-14(16)20-15-12(4)11(3)10(2)9-13(15)21(17,18)19/h9H,5-8H2,1-4H3,(H,17,18,19)/p-1