4-[cyclohexyl(phenyl)methyl]-1,1-dimethyl-piperazin-1-ium iodide

Systemtic Name: 4-[cyclohexyl(phenyl)methyl]-1,1-dimethyl-piperazin-1-ium iodide Openeye Name: 4-[cyclohexyl(phenyl)methyl]-1,1-dimethyl-piperazin-1-ium iodide CAS Name: 4-[cyclohexyl(phenyl)methyl]-1,1-dimethylpiperazin-1-ium iodide IUPAC Name: 4-[cyclohexyl(phenyl)methyl]-1,1-dimethylpiperazin-1-ium iodide Traditional Name: 4-[cyclohexyl(phenyl)methyl]-1,1-dimethyl-piperazin-1-ium iodide Formula: C19H31IN2 MolecularWeight: 414.36731

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C(C2CCCCC2)C3=CC=CC=C3)C.[I-]

Isomeric SMILES

C[N+]1(CCN(CC1)C(C2CCCCC2)C3=CC=CC=C3)C.[I-]

InChI

InChI=1S/C19H31N2.HI/c1-21(2)15-13-20(14-16-21)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18;/h3,5-6,9-10,18-19H,4,7-8,11-16H2,1-2H3;1H/q+1;/p-1