methyl 4-(phenylsulfonyl)butane-1-sulfonate

Systemtic Name: methyl 4-(phenylsulfonyl)butane-1-sulfonate Openeye Name: methyl 4-(benzenesulfonyl)butane-1-sulfonate CAS Name: 4-(benzenesulfonyl)-1-butanesulfonic acid IUPAC Name: methyl 4-(benzenesulfonyl)butane-1-sulfonate Traditional Name: 4-besylbutane-1-sulfonic acid methyl ester Formula: C11H16O5S2 MolecularWeight: 292.37174

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)CCCCS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

COS(=O)(=O)CCCCS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C11H16O5S2/c1-16-18(14,15)10-6-5-9-17(12,13)11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3