2,3-dimethylbutan-2-yl(pyridin-4-ylcarbonyl)azanium chloride

Systemtic Name: 2,3-dimethylbutan-2-yl(pyridin-4-ylcarbonyl)azanium chloride Openeye Name: pyridine-4-carbonyl(1,1,2-trimethylpropyl)ammonium chloride CAS Name: 2,3-dimethylbutan-2-yl-[oxo(pyridin-4-yl)methyl]ammonium chloride IUPAC Name: 2,3-dimethylbutan-2-yl(pyridine-4-carbonyl)azanium chloride Traditional Name: isonicotinoyl(thexyl)ammonium chloride Formula: C12H19ClN2O MolecularWeight: 242.74506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C)[NH2+]C(=O)C1=CC=NC=C1.[Cl-]

Isomeric SMILES

CC(C)C(C)(C)[NH2+]C(=O)C1=CC=NC=C1.[Cl-]

InChI

InChI=1S/C12H18N2O.ClH/c1-9(2)12(3,4)14-11(15)10-5-7-13-8-6-10;/h5-9H,1-4H3,(H,14,15);1H