4-cyclohexyl-1-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]-1-methyl-piperazin-1-ium iodide

Systemtic Name: 4-cyclohexyl-1-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]-1-methyl-piperazin-1-ium iodide Openeye Name: 4-cyclohexyl-1-[3-(5-methoxytetralin-1-yl)propyl]-1-methyl-piperazin-1-ium iodide CAS Name: 4-cyclohexyl-1-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]-1-methylpiperazin-1-ium iodide IUPAC Name: 4-cyclohexyl-1-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]-1-methylpiperazin-1-ium iodide Traditional Name: 4-cyclohexyl-1-[3-(5-methoxytetralin-1-yl)propyl]-1-methyl-piperazin-1-ium iodide Formula: C25H41IN2O MolecularWeight: 512.51031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2CCCCC2)CCCC3CCCC4=C3C=CC=C4OC.[I-]

Isomeric SMILES

C[N+]1(CCN(CC1)C2CCCCC2)CCCC3CCCC4=C3C=CC=C4OC.[I-]

InChI

InChI=1S/C25H41N2O.HI/c1-27(19-16-26(17-20-27)22-11-4-3-5-12-22)18-8-10-21-9-6-14-24-23(21)13-7-15-25(24)28-2;/h7,13,15,21-22H,3-6,8-12,14,16-20H2,1-2H3;1H/q+1;/p-1