2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-methoxybenzoate iodide

Systemtic Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-methoxybenzoate iodide Openeye Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-methoxybenzoate iodide CAS Name: 4-methoxybenzoic acid 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester iodide IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-methoxybenzoate iodide Traditional Name: 4-methoxybenzoic acid 2-(1-methylpiperidin-1-ium-1-yl)ethyl ester iodide Formula: C16H24INO3 MolecularWeight: 405.27113

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC(=O)C2=CC=C(C=C2)OC.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)CCOC(=O)C2=CC=C(C=C2)OC.[I-]

InChI

InChI=1S/C16H24NO3.HI/c1-17(10-4-3-5-11-17)12-13-20-16(18)14-6-8-15(19-2)9-7-14;/h6-9H,3-5,10-13H2,1-2H3;1H/q+1;/p-1