PROPYLBENZILYLCHOLINE MUSTARD

Propylbenzilylcholine Mustard An analog of benzilylcholine mustard. It is an alkylating nitrogen mustard analog that binds specifically and irreversibly to cholinergic muscarinic receptors and is used as an affinity label to isolate and study the receptors.

Molecular Formula: C₂₁H₂₆ClNO₃

InChI: InChI=1/C21H26ClNO3/c1-2-14-23(15-13-22)16-17-26-20(24)21(25,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,25H,2,13-17H2,1H3

InChIKey: InChIKey=ADUIJCCNUGTGDH-UHFFFAOYAN
SMILES: CCCN(CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O)CCCl

Names:
    Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-((2-chloroethyl)propylamino)ethyl ester
    PROPYLBENZILYLCHOLINE MUSTARD
    2-(2-chloroethyl-propyl-amino)ethyl 2-hydroxy-2,2-diphenyl-acetate
    36167-80-3

Registries:
    PubChem CID 37396
    PubChem ID 178773