Escholine iodide

CAS	4277-43-4
Structure
Synonyms	Thalictrine iodide
IUPAC Name	(6aS)-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,11-diol;iodide
Molecular Weight	469.31
Molecular Formula	C20H24NO4.I
Canonical SMILES	C[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)O)OC)C.[I-]
InChI	InChI=1S/C20H23NO4.HI/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18;/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23);1H/t13-;/m0./s1
InChI Key	ODRHNGNRVVELAJ-ZOWNYOTGSA-N
Melting Point	248-249 °C
Purity	98%
Appearance	Powder