1-(1-methylpyridin-1-ium-2-yl)-4-(phenylmethyl)piperazine iodide hydrochloride

Systemtic Name: 1-(1-methylpyridin-1-ium-2-yl)-4-(phenylmethyl)piperazine iodide hydrochloride Openeye Name: 1-benzyl-4-(1-methylpyridin-1-ium-2-yl)piperazine iodide hydrochloride CAS Name: 1-(1-methyl-2-pyridin-1-iumyl)-4-(phenylmethyl)piperazine iodide hydrochloride IUPAC Name: 1-benzyl-4-(1-methylpyridin-1-ium-2-yl)piperazine iodide hydrochloride Traditional Name: 1-benzyl-4-(1-methylpyridin-1-ium-2-yl)piperazine iodide hydrochloride Formula: C17H23ClIN3 MolecularWeight: 431.74209

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1N2CCN(CC2)CC3=CC=CC=C3.Cl.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1N2CCN(CC2)CC3=CC=CC=C3.Cl.[I-]

InChI

InChI=1S/C17H22N3.ClH.HI/c1-18-10-6-5-9-17(18)20-13-11-19(12-14-20)15-16-7-3-2-4-8-16;;/h2-10H,11-15H2,1H3;2*1H/q+1;;/p-1