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(2R,3R,4R)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile

PropertiesImage
MNX_IDMNXM170647 Image of MNXM170647
referencechebi:126377
formulaC23H29N3O3
global charge0
mol weight395.503
InChIKeyFZARLNUCAVCJAO-QNWVGRARSA-N
InChIInChI=1S/C23H29N3O3/c24-14-20-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)21(16-27)26(20)22(28)15-25-10-12-29-13-11-25/h4,6-9,20-21,23,27H,1-3,5,10-13,15-16H2/t20-,21-,23+/m0/s1
SMILESN#C[C@H]1[C@@H](C2=CC=C(C3=CCCCC3)C=C2)[C@H](CO)N1C(=O)CN1CCOCC1
MNX internals
InChI (mnx)InChI=1/C23H29N3O3/c24-14-20-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)21(16-27)26(20)22(28)15-25-10-12-29-13-11-25/h4,6-9,20-21,23,27H,1-3,5,10-13,15-16H2/t20-,21-,23+/m0/s1 Image of MNXM170647
SMILES (mnx)[CH2:1]1[CH2:2][CH:4]=[C:17]([C:18]2=[CH:7][CH:9]=[C:19]([C@@H:23]3[C@H:20]([C:14]#[N:24])[N:26]([C:22]([CH2:15][N:25]4[CH2:10][CH2:12][O:29][CH2:13][CH2:11]4)=[O:28])[C@H:21]3[CH2:16][OH:27])[CH:8]=[CH:6]2)[CH2:5][CH2:3]1
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:126377
chebi:126377
FZARLNUCAVCJAO-QNWVGRARSA-N
(2R,3R,4R)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile