N-(2-iodanylphenyl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-iodanylphenyl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-iodophenyl)-2-[4-(m-tolylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-iodophenyl)-2-[4-[(3-methylphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-iodophenyl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-iodophenyl)-2-[4-(3-methylbenzyl)piperazin-1-ium-1-yl]acetamide Formula: C20H25IN3O+ MolecularWeight: 450.33647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3I

Isomeric SMILES

CC1=CC(=CC=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3I

InChI

InChI=1S/C20H24IN3O/c1-16-5-4-6-17(13-16)14-23-9-11-24(12-10-23)15-20(25)22-19-8-3-2-7-18(19)21/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)/p+1