1-(4-tert-butyl-1-phenyl-cyclohexyl)-1-methyl-piperidin-1-ium iodide

Systemtic Name: 1-(4-tert-butyl-1-phenyl-cyclohexyl)-1-methyl-piperidin-1-ium iodide Openeye Name: 1-(4-tert-butyl-1-phenyl-cyclohexyl)-1-methyl-piperidin-1-ium iodide CAS Name: 1-(4-tert-butyl-1-phenylcyclohexyl)-1-methylpiperidin-1-ium iodide IUPAC Name: 1-(4-tert-butyl-1-phenylcyclohexyl)-1-methylpiperidin-1-ium iodide Traditional Name: 1-(4-tert-butyl-1-phenyl-cyclohexyl)-1-methyl-piperidin-1-ium iodide Formula: C22H36IN MolecularWeight: 441.43241

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)(C2=CC=CC=C2)[N+]3(CCCCC3)C.[I-]

Isomeric SMILES

CC(C)(C)C1CCC(CC1)(C2=CC=CC=C2)[N+]3(CCCCC3)C.[I-]

InChI

InChI=1S/C22H36N.HI/c1-21(2,3)19-13-15-22(16-14-19,20-11-7-5-8-12-20)23(4)17-9-6-10-18-23;/h5,7-8,11-12,19H,6,9-10,13-18H2,1-4H3;1H/q+1;/p-1