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(S)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxy-4-quinolinyl)methanol

PropertiesImage
MNX_IDMNXM174188 Image of MNXM174188
referencechebi:94816
formulaC20H24N2O2
global charge0
mol weight324.424
InChIKeyLOUPRKONTZGTKE-HQUBYHCZSA-N
InChIInChI=1S/C20H24N2O2/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/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13?,14-,19-,20-/m0/s1
SMILESC=C[C@@H]1CN2CC[C@H]1C[C@H]2[C@@H](O)C1=C2C=C(OC)C=CC2=NC=C1
MNX internals
InChI (mnx)InChI=1/C20H24N2O2/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/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13?,14-,19-,20-/m0/s1 Image of MNXM174188
SMILES (mnx)[CH2:1]=[CH:3][CH:13]1[CH2:12][N:22]2[CH2:9][CH2:7][C@H:14]1[CH2:10][C@H:19]2[C@H:20]([C:16]1=[CH:6][CH:8]=[N:21][C:18]2=[C:17]1[CH:11]=[C:15]([O:24][CH3:2])[CH:4]=[CH:5]2)[OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:94816
chebi:94816
LOUPRKONTZGTKE-HQUBYHCZSA-N
(S)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxy-4-quinolinyl)methanol