Apobuscopan

Product Specifications

CAS Number

92714-23-3

Synonyms

3-Oxa-9-azoniatricyclo[3.3.1.02,4]nonane, 9-butyl-9-methyl-7-[(1-oxo-2-phenyl-2-propenyl)oxy]-, bromide, (1α,2β,4β,5α,7β)- (9CI); 3-Oxa-9-azatricyclo[3.3.1.02,4]nonane, 3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane deriv.; Apobuscopan; Apohyoscine Butylbromide; (1R,2R,4S,5S,7s,9r)-9-butyl-9-methyl-7-[(2-phenylprop-2-enoyl)oxy]-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-9-ium (apo-N-butylhyoscine); Hyoscine Butylbromide Imp. G (EP); Hyoscine Butylbromide Impurity G as Bromide

Hazard Statement

Harmful if swallowed

Smiles

[Br-].CCCC[N@@+]1(C)[C@@H]2C[C@H](C[C@H]1[C@@H]3O[C@H]23)OC(=O)C(=C)c4ccccc4

Molecular Formula

C21 H28 N O3 . Br

Molecular Weight

422.36

InChI

InChI=1S/C21H28NO3.BrH/c1-4-5-11-22(3)17-12-16(13-18(22)20-19(17)25-20)24-21(23)14(2)15-9-7-6-8-10-15;/h6-10,16-20H,2,4-5,11-13H2,1,3H3;1H/q+1;/p-1/t16-,17-,18+,19-,20+,22+;