(4-ethylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(4-iodophenyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(4-iodophenyl)methanone Formula: C13H18IN2O+ MolecularWeight: 345.19929

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C13H17IN2O/c1-2-15-7-9-16(10-8-15)13(17)11-3-5-12(14)6-4-11/h3-6H,2,7-10H2,1H3/p+1