benzenesulfonate; octadecylazanium

Systemtic Name: benzenesulfonate; octadecylazanium Openeye Name: benzenesulfonate; octadecylammonium CAS Name: benzenesulfonate; octadecylammonium IUPAC Name: benzenesulfonate; octadecylazanium Traditional Name: stearylammonium besylate Formula: C24H45NO3S MolecularWeight: 427.684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H39N.C6H6O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;7-10(8,9)6-4-2-1-3-5-6/h2-19H2,1H3;1-5H,(H,7,8,9)