trimethyl-(3-methyl-2-morpholin-4-ylcarbonyloxy-6-propan-2-yl-phenyl)azanium iodide

Systemtic Name: trimethyl-(3-methyl-2-morpholin-4-ylcarbonyloxy-6-propan-2-yl-phenyl)azanium iodide Openeye Name: [6-isopropyl-3-methyl-2-(morpholine-4-carbonyloxy)phenyl]-trimethyl-ammonium iodide CAS Name: trimethyl-[3-methyl-2-[4-morpholinyl(oxo)methoxy]-6-propan-2-ylphenyl]ammonium iodide IUPAC Name: trimethyl-[3-methyl-2-(morpholine-4-carbonyloxy)-6-propan-2-ylphenyl]azanium iodide Traditional Name: [6-isopropyl-3-methyl-2-(morpholine-4-carbonyloxy)phenyl]-trimethyl-ammonium iodide Formula: C18H29IN2O3 MolecularWeight: 448.33893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)[N+](C)(C)C)OC(=O)N2CCOCC2.[I-]

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)[N+](C)(C)C)OC(=O)N2CCOCC2.[I-]

InChI

InChI=1S/C18H29N2O3.HI/c1-13(2)15-8-7-14(3)17(16(15)20(4,5)6)23-18(21)19-9-11-22-12-10-19;/h7-8,13H,9-12H2,1-6H3;1H/q+1;/p-1