1-cyclohexyl-1-methyl-piperidin-1-ium; 4-methylbenzenesulfonate

Systemtic Name: 1-cyclohexyl-1-methyl-piperidin-1-ium; 4-methylbenzenesulfonate Openeye Name: 1-cyclohexyl-1-methyl-piperidin-1-ium; 4-methylbenzenesulfonate CAS Name: 1-cyclohexyl-1-methylpiperidin-1-ium; 4-methylbenzenesulfonate IUPAC Name: 1-cyclohexyl-1-methylpiperidin-1-ium; 4-methylbenzenesulfonate Traditional Name: 1-cyclohexyl-1-methyl-piperidin-1-ium tosylate Formula: C19H31NO3S MolecularWeight: 353.51934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CCCCC1)C2CCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CCCCC1)C2CCCCC2

InChI

InChI=1S/C12H24N.C7H8O3S/c1-13(10-6-3-7-11-13)12-8-4-2-5-9-12;1-6-2-4-7(5-3-6)11(8,9)10/h12H,2-11H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1