Search MNXref
 Feedback

Bufuralol

PropertiesImage
MNX_IDMNXM44902 Image of MNXM44902
referencechebi:34593
formulaC16H23NO2
global charge0
mol weight261.365
InChIKeySSEBTPPFLLCUMN-UHFFFAOYSA-N
InChIInChI=1S/C16H23NO2/c1-5-11-7-6-8-12-9-14(19-15(11)12)13(18)10-17-16(2,3)4/h6-9,13,17-18H,5,10H2,1-4H3
SMILESCCC1=C2OC(C(O)CNC(C)(C)C)=CC2=CC=C1
MNX internals
InChI (mnx)InChI=1/C16H23NO2/c1-5-11-7-6-8-12-9-14(19-15(11)12)13(18)10-17-16(2,3)4/h6-9,13,17-18H,5,10H2,1-4H3/t13? Image of MNXM44902
SMILES (mnx)[CH3:1][CH2:5][C:11]1=[C:15]2[C:12](=[CH:8][CH:6]=[CH:7]1)[CH:9]=[C:14]([CH:13]([CH2:10][NH:17][C:16]([CH3:2])([CH3:3])[CH3:4])[OH:18])[O:19]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:34593
chebi:34593
SSEBTPPFLLCUMN-UHFFFAOYSA-N 		Bufuralol
(+/-)-Bufuralol
dl-Bufuralol

seed.compound:cpd09596
seedM:cpd09596
sabiork.compound:21407
sabiorkM:21407
kegg.compound:C13769
keggC:C13769
SSEBTPPFLLCUMN-UHFFFAOYSA-N
SSEBTPPFLLCUMN-UHFFFAOYSA-O 		Bufuralol
hmdb:HMDB0249434
SSEBTPPFLLCUMN-UHFFFAOYSA-N 		Bufuralol
2-(tert-butylamino)-1-(7-ethyl-1-benzofuran-2-yl)ethan-1-ol
Bufuralol, (DL)-(+-)-isomer
Bufuralol, hydrochloride
Bufuralol, hydrochloride, (D)-(+)-isomer
Bufuralol, hydrochloride, (DL)-(+-)-isomer
Bufuralol, hydrochloride, (L)-(-)-isomer
bufuralol

keggC:M_C13769
seedM:M_cpd09596 		secondary/obsolete/fantasy identifier