Names
IUPAC name (R)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
Other names (8α,9R)-10,11-Dihydro-6'-methoxycinchonan-9-ol
Identifiers
CAS NumberY
3D model (JSmol)
ChEBI
ChEMBL
ChemSpiderY
DrugBank
ECHA InfoCard
EC Number208-334-0
PubChem CID
UNIIY
CompTox Dashboard (EPA)
InChI InChI=1S/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14-,19-,20+/m0/s1YKey: LJOQGZACKSYWCH-WZBLMQSHSA-NYInChI=1/C20H26N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3/t13-,14-,19-,20+/m0/s1Key: LJOQGZACKSYWCH-WZBLMQSHBC
SMILES O[C@@H](C1N2CCC(C(CC)C2)C1)C3=CC=NC4=CC=C(OC)C=C43O(c4cc1c(nccc1[C@@H](O)[C@H]2N3CC[C@@H](C2)[C@@H](CC)C3)cc4)C
Properties
Chemical formulaC20H26N2O2
Molar mass326.440 g·mol−1
Melting point173–175 °C
Hazards
GHS labelling:
Pictograms
Signal wordWarning
Hazard statementsH302, H312, H332
Precautionary statementsP261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Y verify (what is YN ?) Infobox references