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1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate

PropertiesImage
MNX_IDMNXM119863 Image of MNXM119863
referencechebi:143782
formulaC23H28N2O3
global charge0
mol weight380.488
InChIKeyUUOJIACWOAYWEZ-UHFFFAOYSA-N
InChIInChI=1S/C23H28N2O3/c1-16-13-19-20(25-16)11-8-12-21(19)27-15-18(14-24-23(2,3)4)28-22(26)17-9-6-5-7-10-17/h5-13,18,24-25H,14-15H2,1-4H3
SMILESCC1=CC2=C(C=CC=C2OCC(CNC(C)(C)C)OC(=O)C2=CC=CC=C2)N1
MNX internals
InChI (mnx)InChI=1/C23H28N2O3/c1-16-13-19-20(25-16)11-8-12-21(19)27-15-18(14-24-23(2,3)4)28-22(26)17-9-6-5-7-10-17/h5-13,18,24-25H,14-15H2,1-4H3/t18? Image of MNXM119863
SMILES (mnx)[CH3:1][C:16]1=[CH:13][C:19]2=[C:20]([CH:11]=[CH:8][CH:12]=[C:21]2[O:27][CH2:15][CH:18]([CH2:14][NH:24][C:23]([CH3:2])([CH3:3])[CH3:4])[O:28][C:22]([C:17]2=[CH:9][CH:6]=[CH:5][CH:7]=[CH:10]2)=[O:26])[NH:25]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:143782
chebi:143782
UUOJIACWOAYWEZ-UHFFFAOYSA-N 		1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate

kegg.drug:D07537
keggD:D07537
UUOJIACWOAYWEZ-UHFFFAOYSA-N 		Bopindolol (INN)
Sandonorm (TN)
hmdb:HMDB0015696
UUOJIACWOAYWEZ-UHFFFAOYSA-N 		Bopindolol
1-(Tert-butylamino)-3-((2-methylindo)-4-yl)-2-propanol benzoate
1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate
Bopindolol, (+-)-isomer
Sandonorm
bopindolol

CHEBI:76749
chebi:76749 		bopindolol
(+-)-1-[(1,1-Dimethylethyl)amino]-3-[(2-methyl-1H-indol-4-yl)oxy]-2-propanol benzoate
(+-)-bopindolol
(RS)-bopindolol
LT 31-200
Sandonorm
bopindololum
rac-1-(tert-butylamino)-3-[(2-methyl-1H-indol-4-yl)oxy]propan-2-yl benzoate
rac-bopindolol
racemic bopindolol

hmdb:HMDB15696
keggD:M_D07537 		secondary/obsolete/fantasy identifier