2-[4-(3-iodanylphenyl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(3-iodanylphenyl)carbonylpiperazin-1-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(3-iodobenzoyl)piperazin-1-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(3-iodophenyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(3-iodobenzoyl)piperazin-1-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(3-iodobenzoyl)piperazin-1-ium-1-yl]-1-piperidino-ethanone Formula: C18H25IN3O2+ MolecularWeight: 442.31447

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)I

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C18H24IN3O2/c19-16-6-4-5-15(13-16)18(24)22-11-9-20(10-12-22)14-17(23)21-7-2-1-3-8-21/h4-6,13H,1-3,7-12,14H2/p+1