o-Phenylalanine mustard
Molecular Formula:
C
13
H
18
Cl
2
N
2
O
2
InChI:
InChI=1/C13H18Cl2N2O2/c14-5-7-17(8-6-15)12-4-2-1-3-10(12)9-11(16)13(18)19/h1-4,11H,5-9,16H2,(H,18,19)/f/h18H
InChIKey:
InChIKey=ZJHNCWIVJDCKSB-GPQMBLKYCY
SMILES:
C1=CC=C(C(=C1)CC(C(=O)O)N)N(CCCl)CCCl
Names:
CB 1729
FDA 0109
Merophan
NSC-57199
Ortho-phenylalanine mustard
o-Di-2-chloroethylamino-DL-phenylalanine
o-DL-Sarcolysin
o-Merphalan
o-Phenylalanine mustard
(+-)-O-Phenylalanine mustard
2-amino-3-[2-[bis(2-chloroethyl)amino]phenyl]propanoic acid
Registries:
PubChem CID 9571
PubChem ID 152785