2-acetyloxyethyl(trimethyl)azanium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide

Systemtic Name: 2-acetyloxyethyl(trimethyl)azanium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide Openeye Name: 2-acetoxyethyl(trimethyl)ammonium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide CAS Name: 2-acetyloxyethyl(trimethyl)ammonium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide IUPAC Name: 2-acetyloxyethyl(trimethyl)azanium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide Traditional Name: 2-acetoxyethyl(trimethyl)ammonium; N-(4-iodophenyl)-1-methyl-4H-pyridine-3-carboxamide Formula: C20H29IN3O3+ MolecularWeight: 486.36703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[N+](C)(C)C.CN1C=CCC(=C1)C(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

CC(=O)OCC[N+](C)(C)C.CN1C=CCC(=C1)C(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C13H13IN2O.C7H16NO2/c1-16-8-2-3-10(9-16)13(17)15-12-6-4-11(14)5-7-12;1-7(9)10-6-5-8(2,3)4/h2,4-9H,3H2,1H3,(H,15,17);5-6H2,1-4H3/q;+1