(1-methylpiperidin-1-ium-4-yl) 2-iodanylbenzoate

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 2-iodanylbenzoate Openeye Name: (1-methylpiperidin-1-ium-4-yl) 2-iodobenzoate CAS Name: 2-iodobenzoic acid (1-methyl-4-piperidin-1-iumyl) ester IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 2-iodobenzoate Traditional Name: 2-iodobenzoic acid (1-methylpiperidin-1-ium-4-yl) ester Formula: C13H17INO2+ MolecularWeight: 346.18405

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)C2=CC=CC=C2I

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C13H16INO2/c1-15-8-6-10(7-9-15)17-13(16)11-4-2-3-5-12(11)14/h2-5,10H,6-9H2,1H3/p+1