3-methyl-5-[(1-methylpiperazin-1-ium-1-yl)methyl]-1,2-oxazole iodide

Systemtic Name: 3-methyl-5-[(1-methylpiperazin-1-ium-1-yl)methyl]-1,2-oxazole iodide Openeye Name: 3-methyl-5-[(1-methylpiperazin-1-ium-1-yl)methyl]isoxazole iodide CAS Name: 3-methyl-5-[(1-methyl-1-piperazin-1-iumyl)methyl]isoxazole iodide IUPAC Name: 3-methyl-5-[(1-methylpiperazin-1-ium-1-yl)methyl]-1,2-oxazole iodide Traditional Name: 3-methyl-5-[(1-methylpiperazin-1-ium-1-yl)methyl]isoxazole iodide Formula: C10H18IN3O MolecularWeight: 323.17389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C[N+]2(CCNCC2)C.[I-]

Isomeric SMILES

CC1=NOC(=C1)C[N+]2(CCNCC2)C.[I-]

InChI

InChI=1S/C10H18N3O.HI/c1-9-7-10(14-12-9)8-13(2)5-3-11-4-6-13;/h7,11H,3-6,8H2,1-2H3;1H/q+1;/p-1