1-decylpyridin-1-ium; 4-methylbenzenesulfonic acid

Systemtic Name: 1-decylpyridin-1-ium; 4-methylbenzenesulfonic acid Openeye Name: 1-decylpyridin-1-ium; 4-methylbenzenesulfonic acid CAS Name: 1-decylpyridin-1-ium; 4-methylbenzenesulfonic acid IUPAC Name: 1-decylpyridin-1-ium; 4-methylbenzenesulfonic acid Traditional Name: 1-decylpyridin-1-ium; tosylic acid Formula: C22H34NO3S+ MolecularWeight: 392.57526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C15H26N.C7H8O3S/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16;1-6-2-4-7(5-3-6)11(8,9)10/h9,11-12,14-15H,2-8,10,13H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;