(8-methyl-8-azoniabicyclo[3.2.1]oct-3-yl) 2-(4-tert-butylphenyl)prop-2-enoate chloride

Molecular Formula: C21H30ClNO2


InChI: InChI=1/C21H29NO2.ClH/c1-14(15-6-8-16(9-7-15)21(2,3)4)20(23)24-19-12-17-10-11-18(13-19)22(17)5;/h6-9,17-19H,1,10-13H2,2-5H3;1H/fC21H30NO2.Cl/h22H;1h/q+1;-1

InChIKey: InChIKey=NNADEMKNXDZEKW-JEGFKAPYCB
SMILES: CC(C)(C)C1=CC=C(C=C1)C(=C)C(=O)OC2CC3CCC(C2)[NH+]3C.[Cl-]

Names:
    ATROPIC ACID, 4'-tert-BUTYL-, 3-TROPANYL ESTER, HYDROCHLORIDE, HEMIHYDRATE
    (8-methyl-8-azoniabicyclo[3.2.1]oct-3-yl) 2-(4-tert-butylphenyl)prop-2-enoate chloride
    3-Tropanyl 4'-tert-butylatropate hydrochloride hemihydrate
    4'-tert-Butylatropic acid, 3-tropanyl ester, hydrochloride, hemihydrate
    64048-72-2

Registries:
    PubChem CID 46810
    PubChem ID 186273