pentyl benzenesulfonate

Systemtic Name: pentyl benzenesulfonate Openeye Name: pentyl benzenesulfonate CAS Name: benzenesulfonic acid pentyl ester IUPAC Name: pentyl benzenesulfonate Traditional Name: benzenesulfonic acid amyl ester Formula: C11H16O3S MolecularWeight: 228.30794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCOS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C11H16O3S/c1-2-3-7-10-14-15(12,13)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3