1-butyl-3-pentyl-pyridin-1-ium; methanesulfonate

Systemtic Name: 1-butyl-3-pentyl-pyridin-1-ium; methanesulfonate Openeye Name: 1-butyl-3-pentyl-pyridin-1-ium; methanesulfonate CAS Name: 1-butyl-3-pentylpyridin-1-ium; methanesulfonate IUPAC Name: 1-butyl-3-pentylpyridin-1-ium; methanesulfonate Traditional Name: 3-amyl-1-butyl-pyridin-1-ium mesylate Formula: C15H27NO3S MolecularWeight: 301.44478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C[N+](=CC=C1)CCCC.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCCC1=C[N+](=CC=C1)CCCC.CS(=O)(=O)[O-]

InChI

InChI=1S/C14H24N.CH4O3S/c1-3-5-7-9-14-10-8-12-15(13-14)11-6-4-2;1-5(2,3)4/h8,10,12-13H,3-7,9,11H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1