1-octadecylpyridin-1-ium sulfate

Systemtic Name: 1-octadecylpyridin-1-ium sulfate Openeye Name: 1-octadecylpyridin-1-ium sulfate CAS Name: 1-octadecylpyridin-1-ium sulfate IUPAC Name: 1-octadecylpyridin-1-ium sulfate Traditional Name: 1-stearylpyridin-1-ium sulfate Formula: C23H42NO4S- MolecularWeight: 428.64888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C23H42N.H2O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-24-22-19-17-20-23-24;1-5(2,3)4/h17,19-20,22-23H,2-16,18,21H2,1H3;(H2,1,2,3,4)/q+1;/p-2