BEVONIUM METILSULFATE

Molecular Formula: C₂₃H₃₁NO₇S

InChI: InChI=1/C22H28NO3.CH4O4S/c1-23(2)16-10-9-15-20(23)17-26-21(24)22(25,18-11-5-3-6-12-18)19-13-7-4-8-14-19;1-5-6(2,3)4/h3-8,11-14,20,25H,9-10,15-17H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1/fC22H28NO3.CH3O4S/qm;-1

InChIKey: InChIKey=AXKJGGRSAVLXTE-OROIAJDKCD
SMILES: C[N+]1(CCCCC1COC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C.COS(=O)(=O)[O-]

Names:
    BEVONIUM METILSULFATE
    (1,1-dimethyl-3,4,5,6-tetrahydro-2H-pyridin-2-yl)methyl 2-hydroxy-2,2-diphenyl-acetate; sulfonatooxymethane
    23277-37-4

Registries:
    PubChem CID 31799
    PubChem ID 173844