4-methylbenzenesulfonic acid; 1-nonylpyridin-1-ium

Systemtic Name: 4-methylbenzenesulfonic acid; 1-nonylpyridin-1-ium Openeye Name: 4-methylbenzenesulfonic acid; 1-nonylpyridin-1-ium CAS Name: 4-methylbenzenesulfonic acid; 1-nonylpyridin-1-ium IUPAC Name: 4-methylbenzenesulfonic acid; 1-nonylpyridin-1-ium Traditional Name: 1-nonylpyridin-1-ium; tosylic acid Formula: C21H32NO3S+ MolecularWeight: 378.54868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H24N.C7H8O3S/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15;1-6-2-4-7(5-3-6)11(8,9)10/h8,10-11,13-14H,2-7,9,12H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;