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N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxamide

PropertiesImage
MNX_IDMNXM102929 Image of MNXM102929
referencechebi:91712
formulaC17H20ClN3O3
global charge0
mol weight349.818
InChIKeyWUKZPHOXUVCQOR-UHFFFAOYSA-N
InChIInChI=1S/C17H20ClN3O3/c1-20-14-7-11(18)6-12(16(14)24-9-15(20)22)17(23)19-13-8-21-4-2-10(13)3-5-21/h6-7,10,13H,2-5,8-9H2,1H3,(H,19,23)
SMILESCN1C(=O)COC2=C1C=C(Cl)C=C2C(=O)NC1CN2CCC1CC2
MNX internals
InChI (mnx)InChI=1/C17H20ClN3O3/c1-20-14-7-11(18)6-12(16(14)24-9-15(20)22)17(23)19-13-8-21-4-2-10(13)3-5-21/h6-7,10,13H,2-5,8-9H2,1H3,(H,19,23)/t13? Image of MNXM102929
SMILES (mnx)[CH3:1][N:20]1[C:14]2=[CH:7][C:11]([Cl:18])=[CH:6][C:12]([C:17](=[N:19][CH:13]3[CH2:8][N:21]4[CH2:4][CH2:2][CH:10]3[CH2:3][CH2:5]4)[OH:23])=[C:16]2[O:24][CH2:9][C:15]1=[O:22]
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:91712
chebi:91712
WUKZPHOXUVCQOR-UHFFFAOYSA-N 		N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloro-4-methyl-3-oxo-1,4-benzoxazine-8-carboxamide
azasetron HCl
azasetron hydrochloride
nazasetron

kegg.drug:D07481
keggD:D07481
WUKZPHOXUVCQOR-UHFFFAOYSA-N 		Azasetron (INN)
hmdb:HMDB0248768
WUKZPHOXUVCQOR-UHFFFAOYSA-N 		Azasetron
Azasetron HCL
Azasetron, (+-)-isomer
N-(1-azabicyclo(2.2.2)Oct-3-yl)-6-chloro-4-methyl-3-oxo-3,4 -dihydro-2H-1,4-benzoxazine-8-carboxamide hydrochloride
N-{1-azabicyclo[2.2.2]octan-3-yl}-6-chloro-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-8-carboximidate
N-{1-azabicyclo[2.2.2]octan-3-yl}-6-chloro-4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-8-carboximidic acid
azasetron

keggD:M_D07481 		secondary/obsolete/fantasy identifier