butyl-[2-(3-ethanoyl-2-methyl-indolizin-1-yl)propyl]-dimethyl-azanium iodide

Systemtic Name: butyl-[2-(3-ethanoyl-2-methyl-indolizin-1-yl)propyl]-dimethyl-azanium iodide Openeye Name: 2-(3-acetyl-2-methyl-indolizin-1-yl)propyl-butyl-dimethyl-ammonium iodide CAS Name: 2-(3-acetyl-2-methyl-1-indolizinyl)propyl-butyl-dimethylammonium iodide IUPAC Name: 2-(3-acetyl-2-methylindolizin-1-yl)propyl-butyl-dimethylazanium iodide Traditional Name: 2-(3-acetyl-2-methyl-indolizin-1-yl)propyl-butyl-dimethyl-ammonium iodide Formula: C20H31IN2O MolecularWeight: 442.37741

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[I-]

Isomeric SMILES

CCCC[N+](C)(C)CC(C)C1=C2C=CC=CN2C(=C1C)C(=O)C.[I-]

InChI

InChI=1S/C20H31N2O.HI/c1-7-8-13-22(5,6)14-15(2)19-16(3)20(17(4)23)21-12-10-9-11-18(19)21;/h9-12,15H,7-8,13-14H2,1-6H3;1H/q+1;/p-1