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Exploring 773. To explore a different substance…

IUPAC name

2-(tert-Butylamino)-1-(3,4-dichlorophenyl)propan-1-one

ID 773 · Formula C₁₃H₁₇Cl₂NO · Molecular weight 274.186

InChI InChI=1S/C13H17Cl2NO/c1-8(16-13(2,3)4)12(17)9-5-6-10(14)11(15)7-9/h5-8,16H,1-4H3

InChI Key MXUDEADPGZWZCH-UHFFFAOYSA-N This stereoisomer Any stereoisomer

SMILES CC(C(=O)c1ccc(c(c1)Cl)Cl)NC(C)(C)C

ChemSpider 24633245
PubChem 45487890

Carroll, FI; Blough, BE; Abraham, P; Mills, AC; Holleman, JA; Wolckenhauer, SA; Decker, AM; Landavazo, A; McElroy, KT; Navarro, HA; Gatch, MB; Forster, MJ. Synthesis and biological evaluation of bupropion analogues as potential pharmacotherapies for cocaine addiction J. Med. Chem., 12 Nov 2009, 52 (21), 6768–2781. 1.1 MB. https://doi.org/10.1021/jm901189z #1j NMR,other

Carroll, FI; Blough, BE; Mascarella, SW; Navarro, HA; Eaton, JB; Lukas, RJ; Damaj, MI. Synthesis and biological evaluation of bupropion analogues as potential pharmacotherapies for smoking cessation J. Med. Chem., 11 Mar 2010, 53 (5), 2204–2214. 948 kB. https://doi.org/10.1021/jm9017465 #2k MS,NMR,other

777

7 Dec 2019 · · Isomer Design