3-iodanyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide

Systemtic Name: 3-iodanyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Openeye Name: 3-iodo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide CAS Name: 3-iodo-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzamide IUPAC Name: 3-iodo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Traditional Name: 3-iodo-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Formula: C16H24IN2O+ MolecularWeight: 387.27903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=CC=C2)I

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=CC=C2)I

InChI

InChI=1S/C16H23IN2O/c1-13-6-2-3-10-19(13)11-5-9-18-16(20)14-7-4-8-15(17)12-14/h4,7-8,12-13H,2-3,5-6,9-11H2,1H3,(H,18,20)/p+1/t13-/m0/s1