Phenylbutyric acid nitrogen mustard

Molecular Formula: C14H19Cl2NO2


InChI: InChI=1/C14H19Cl2NO2/c15-8-10-17(11-9-16)13-6-4-12(5-7-13)2-1-3-14(18)19/h4-7H,1-3,8-11H2,(H,18,19)/f/h18H

InChIKey: InChIKey=JCKYGMPEJWAADB-GPQMBLKYCN
SMILES: OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl

CAS number 305-03-3

Names:
    Ambochlorin
    Chlorambucil (USP)
    Chlorambucil
    chlorambucil
    Chloraminophen
    gamma-(p-Bis(2-chloroethyl)aminophenyl)butyric acid
    KBio3_001191
    Leukeran (TN)
    N,N-Di-2-chloroethyl-gamma-p-aminophenylbutyric acid
    Phenylbutyric acid nitrogen mustard
    4-(p-(Bis(2-chloroethyl)amino)phenyl)butyric acid
    4-[4-[bis(2-chloroethyl)amino]phenyl]butanoic acid

Registries:
    PubChem CID 2708
    Beilstein =999011
    CAS 305-03-3 (from NIST)
    ChEBI 28830
    Kegg D00266
    PubChem ID 11371291
    PubChem ID 7847332