4-ethenylbenzenesulfonate; octadecylazanium

Systemtic Name: 4-ethenylbenzenesulfonate; octadecylazanium Openeye Name: octadecylammonium; 4-vinylbenzenesulfonate CAS Name: 4-ethenylbenzenesulfonate; octadecylammonium IUPAC Name: 4-ethenylbenzenesulfonate; octadecylazanium Traditional Name: stearylammonium; 4-vinylbesylate Formula: C26H47NO3S MolecularWeight: 453.72128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[NH3+].C=CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[NH3+].C=CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C18H39N.C8H8O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-2-7-3-5-8(6-4-7)12(9,10)11/h2-19H2,1H3;2-6H,1H2,(H,9,10,11)