hexan-2-yl ethanesulfonate

Systemtic Name: hexan-2-yl ethanesulfonate Openeye Name: 1-methylpentyl ethanesulfonate CAS Name: ethanesulfonic acid hexan-2-yl ester IUPAC Name: hexan-2-yl ethanesulfonate Traditional Name: ethanesulfonic acid 1-methylpentyl ester Formula: C8H18O3S MolecularWeight: 194.29172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OS(=O)(=O)CC

Isomeric SMILES

CCCCC(C)OS(=O)(=O)CC

InChI

InChI=1S/C8H18O3S/c1-4-6-7-8(3)11-12(9,10)5-2/h8H,4-7H2,1-3H3