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

Systemtic Name: 1-cyclohexyl-1-ethyl-piperidin-1-ium; 4-methylbenzenesulfonate Openeye Name: 1-cyclohexyl-1-ethyl-piperidin-1-ium; 4-methylbenzenesulfonate CAS Name: 1-cyclohexyl-1-ethylpiperidin-1-ium; 4-methylbenzenesulfonate IUPAC Name: 1-cyclohexyl-1-ethylpiperidin-1-ium; 4-methylbenzenesulfonate Traditional Name: 1-cyclohexyl-1-ethyl-piperidin-1-ium tosylate Formula: C20H33NO3S MolecularWeight: 367.54592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26N.C7H8O3S/c1-2-14(11-7-4-8-12-14)13-9-5-3-6-10-13;1-6-2-4-7(5-3-6)11(8,9)10/h13H,2-12H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1