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IUPAC name

6,8-Dichloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

ID 2748 · Formula C₁₁H₁₃Cl₂N · Molecular weight 230.134

InChI InChI=1S/C11H13Cl2N/c1-7-6-14-3-2-9-10(7)4-8(12)5-11(9)13/h4-5,7,14H,2-3,6H2,1H3

InChI Key LVDZEHWRCDOGFA-UHFFFAOYSA-N This stereoisomer Any stereoisomer

SMILES Clc1cc2C(C)CNCCc2c(c1)Cl

ChemSpider 9335664
PubChem 11160564
Wikidata Q82280077

Smith, BM; Smith, JM; Tsai, JH; Schultz, JA; Gilson, CA; Estrada, SA; Chen, RR; Park, DM; Prieto, EB; Gallardo, CS; Sengupta, D; Thomsen, WJ; Saldana, HR; Whelan, KT; Menzaghi, F; Webb, RR; Beeley, NRA. Discovery and SAR of new benzazepines as potent and selective 5-HT_2C receptor agonists for the treatment of obesity Bioorg. Med. Chem. Lett., 1 Mar 2005, 15 (5), 1467–1470. 122 kB. https://doi.org/10.1016/j.bmcl.2004.12.080 #18a

Smith, BM; Smith, JM; Tsai, JH; Schultz, JA; Gilson, CA; Estrada, SA; Thomsen, WJ. Discovery and Structure−Activity Relationship of (1R)-8-Chloro-2,3,4,5-tetrahydro-1-methyl-1H-3-benzazepine (Lorcaserin), a Selective Serotonin 5-HT_2C Receptor Agonist for the Treatment of Obesity J. Med. Chem., 1 Jan 2008, 51 (2), 305–313. 158 kB. https://doi.org/10.1021/jm0709034 #7cc MS,NMR

2749

2750

10006

7 Dec 2019 · · Isomer Design