Molecule ID: 1993

IUPAC Name: 2-acetyloxypropyl(trimethyl)azanium

Description: The molecule is a quaternary ammonium ion in which the nitrogen is substituted with three methyl groups and a 2-acetoxypropyl group. Parasympathomimetic bronchoconstrictor drug used in clinical diagnosis. It has a role as a muscarinic agonist, a bronchoconstrictor agent, an epitope, a cholinergic agonist and a vasodilator agent. It is a quaternary ammonium ion and an acetate ester.

SMILES: CC(=O)OC(C)C[N+](C)(C)C

SELFIES: [C][C][=Branch1][C][=O][O][C][Branch1][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C]

InChI: InChI=1S/C8H18NO2/c1-7(11-8(2)10)6-9(3,4)5/h7H,6H2,1-5H3/q+1

Molecular Properties:
- Polar Surface Area: 26.3 Ų
- LogP: 0.6