propyl benzenesulfonate

Systemtic Name: propyl benzenesulfonate Openeye Name: propyl benzenesulfonate CAS Name: benzenesulfonic acid propyl ester IUPAC Name: propyl benzenesulfonate Traditional Name: benzenesulfonic acid propyl ester Formula: C9H12O3S MolecularWeight: 200.25478

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CCCOS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H12O3S/c1-2-8-12-13(10,11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3