Denatonium Chloride

Molecular Formula: C21H29ClN2O


InChI: InChI=1/C21H28N2O.ClH/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;/h7-14H,5-6,15-16H2,1-4H3;1H/fC21H29N2O.Cl/h22H;1h/q+1;-1

InChIKey: InChIKey=YNQALPDYZRNHNK-LTVPLCKOCJ
SMILES: CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.[Cl-]

Names:
    Ammonium, benzyldiethyl((2,6-xylylcarbamoyl)methyl)-, chloride
    Benzenemethanaminium, N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-, chloride
    Benzyldiethyl((2,6-xylylcarbamoyl)methyl)ammonium chloride
    benzyl-[(2,6-dimethylphenyl)carbamoylmethyl]-diethyl-azanium chloride
    Denatonium Chloride
    1674-99-3

Registries:
    PubChem CID 15487
    PubChem ID 158803