1,1-dimethyl-4-[[2-(phenylmethyl)phenyl]methyl]piperazin-1-ium iodide

Systemtic Name: 1,1-dimethyl-4-[[2-(phenylmethyl)phenyl]methyl]piperazin-1-ium iodide Openeye Name: 4-[(2-benzylphenyl)methyl]-1,1-dimethyl-piperazin-1-ium iodide CAS Name: 1,1-dimethyl-4-[[2-(phenylmethyl)phenyl]methyl]piperazin-1-ium iodide IUPAC Name: 4-[(2-benzylphenyl)methyl]-1,1-dimethylpiperazin-1-ium iodide Traditional Name: 4-(2-benzylbenzyl)-1,1-dimethyl-piperazin-1-ium iodide Formula: C20H27IN2 MolecularWeight: 422.34625

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)CC2=CC=CC=C2CC3=CC=CC=C3)C.[I-]

Isomeric SMILES

C[N+]1(CCN(CC1)CC2=CC=CC=C2CC3=CC=CC=C3)C.[I-]

InChI

InChI=1S/C20H27N2.HI/c1-22(2)14-12-21(13-15-22)17-20-11-7-6-10-19(20)16-18-8-4-3-5-9-18;/h3-11H,12-17H2,1-2H3;1H/q+1;/p-1