3-[4-(3-chlorophenyl)-1-methyl-piperazin-1-ium-1-yl]propanamide iodide

Systemtic Name: 3-[4-(3-chlorophenyl)-1-methyl-piperazin-1-ium-1-yl]propanamide iodide Openeye Name: 3-[4-(3-chlorophenyl)-1-methyl-piperazin-1-ium-1-yl]propanamide iodide CAS Name: 3-[4-(3-chlorophenyl)-1-methyl-1-piperazin-1-iumyl]propanamide iodide IUPAC Name: 3-[4-(3-chlorophenyl)-1-methylpiperazin-1-ium-1-yl]propanamide iodide Traditional Name: 3-[4-(3-chlorophenyl)-1-methyl-piperazin-1-ium-1-yl]propionamide iodide Formula: C14H21ClIN3O MolecularWeight: 409.69351

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=CC(=CC=C2)Cl)CCC(=O)N.[I-]

Isomeric SMILES

C[N+]1(CCN(CC1)C2=CC(=CC=C2)Cl)CCC(=O)N.[I-]

InChI

InChI=1S/C14H20ClN3O.HI/c1-18(8-5-14(16)19)9-6-17(7-10-18)13-4-2-3-12(15)11-13;/h2-4,11H,5-10H2,1H3,(H-,16,19);1H