Description
Atropine methyl nitrate (CAS# 52-88-0 ) is a useful research chemical.
Synonyms
metropine; n-methylatropinenitrate; N-METHYLATROPINIUM NITRATE; Atropinmethonitrat; AMN, Methylatropine nitrate; ATROPINE METHYL NITRATE; ATROPINE METHONITRATE; ,endo-(+/-)-,nitrate(salt)
IUPAC Name
[(1S,5R)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate;nitrate
Molecular Formula
C18H26N2O6
Canonical SMILES
C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C.[N+](=O)([O-])[O-]
InChI
InChI=1S/C18H26NO3.NO3/c1-19(2)14-8-9-15(19)11-16(10-14)22-18(21)17(12-20)13-6-4-3-5-7-13;2-1(3)4/h3-7,14-17,20H,8-12H2,1-2H3;/q+1;-1/t14-,15+,16?,17?;
InChIKey
NEDVJZNVOSNSHF-ZNHDNBJUSA-N
Safety Statements
22-36-45-25
Toxicity
LD50 oral in rat: 1902mg/kg
Water Solubility
H2O: 50 mg/mL