benzenesulfonate; propylazanium

Systemtic Name: benzenesulfonate; propylazanium Openeye Name: benzenesulfonate; propylammonium CAS Name: benzenesulfonate; propylammonium IUPAC Name: benzenesulfonate; propylazanium Traditional Name: propylammonium besylate Formula: C9H15NO3S MolecularWeight: 217.2853

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH3+].C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCC[NH3+].C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C6H6O3S.C3H9N/c7-10(8,9)6-4-2-1-3-5-6;1-2-3-4/h1-5H,(H,7,8,9);2-4H2,1H3