2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methoxybenzoate iodide

Systemtic Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methoxybenzoate iodide Openeye Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methoxybenzoate iodide CAS Name: 4-methoxybenzoic acid 2-(4-methyl-4-morpholin-4-iumyl)ethyl ester iodide IUPAC Name: 2-(4-methylmorpholin-4-ium-4-yl)ethyl 4-methoxybenzoate iodide Traditional Name: 4-methoxybenzoic acid 2-(4-methylmorpholin-4-ium-4-yl)ethyl ester iodide Formula: C15H22INO4 MolecularWeight: 407.24395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CCOC(=O)C2=CC=C(C=C2)OC.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CCOC(=O)C2=CC=C(C=C2)OC.[I-]

InChI

InChI=1S/C15H22NO4.HI/c1-16(7-10-19-11-8-16)9-12-20-15(17)13-3-5-14(18-2)6-4-13;/h3-6H,7-12H2,1-2H3;1H/q+1;/p-1