3-(phenylsulfonyl)propane-1-sulfonate

Systemtic Name: 3-(phenylsulfonyl)propane-1-sulfonate Openeye Name: 3-(benzenesulfonyl)propane-1-sulfonate CAS Name: 3-(benzenesulfonyl)-1-propanesulfonate IUPAC Name: 3-(benzenesulfonyl)propane-1-sulfonate Traditional Name: 3-besylpropane-1-sulfonate Formula: C9H11O5S2- MolecularWeight: 263.31064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H12O5S2/c10-15(11,7-4-8-16(12,13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,13,14)/p-1