2-[4-[2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[2-[(2-iodanylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[2-(2-iodoanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[2-(2-iodoanilino)-2-oxoethyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[2-(2-iodoanilino)-2-oxoethyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-[2-(2-iodoanilino)-2-keto-ethyl]piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C17H26IN4O2+ MolecularWeight: 445.31841

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=CC=CC=C2I

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=CC=CC=C2I

InChI

InChI=1S/C17H25IN4O2/c1-2-7-19-16(23)12-21-8-10-22(11-9-21)13-17(24)20-15-6-4-3-5-14(15)18/h3-6H,2,7-13H2,1H3,(H,19,23)(H,20,24)/p+1