1-butyl-4-methoxy-1-methyl-4-(phenylmethyl)piperazine-1,4-diium diiodide

Systemtic Name: 1-butyl-4-methoxy-1-methyl-4-(phenylmethyl)piperazine-1,4-diium diiodide Openeye Name: 1-benzyl-4-butyl-1-methoxy-4-methyl-piperazine-1,4-diium diiodide CAS Name: 1-butyl-4-methoxy-1-methyl-4-(phenylmethyl)piperazine-1,4-diium diiodide IUPAC Name: 1-benzyl-4-butyl-1-methoxy-4-methylpiperazine-1,4-diium diiodide Traditional Name: 1-benzyl-4-butyl-1-methoxy-4-methyl-piperazine-1,4-diium diiodide Formula: C17H30I2N2O MolecularWeight: 532.24184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CC[N+](CC1)(CC2=CC=CC=C2)OC)C.[I-].[I-]

Isomeric SMILES

CCCC[N+]1(CC[N+](CC1)(CC2=CC=CC=C2)OC)C.[I-].[I-]

InChI

InChI=1S/C17H30N2O.2HI/c1-4-5-11-18(2)12-14-19(20-3,15-13-18)16-17-9-7-6-8-10-17;;/h6-10H,4-5,11-16H2,1-3H3;2*1H/q+2;;/p-2