1-dodecylpyridin-1-ium; phenyl sulfate

Systemtic Name: 1-dodecylpyridin-1-ium; phenyl sulfate Openeye Name: 1-dodecylpyridin-1-ium; phenyl sulfate CAS Name: 1-dodecylpyridin-1-ium; phenyl sulfate IUPAC Name: 1-dodecylpyridin-1-ium; phenyl sulfate Traditional Name: 1-laurylpyridin-1-ium; phenyl sulfate Formula: C23H35NO4S MolecularWeight: 421.5933

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+]1=CC=CC=C1.C1=CC=C(C=C1)OS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC[N+]1=CC=CC=C1.C1=CC=C(C=C1)OS(=O)(=O)[O-]

InChI

InChI=1S/C17H30N.C6H6O4S/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18;7-11(8,9)10-6-4-2-1-3-5-6/h11,13-14,16-17H,2-10,12,15H2,1H3;1-5H,(H,7,8,9)/q+1;/p-1