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4-Chloro-alpha-[4-[2-(diethylamino)ethoxy]phenyl]-alpha-phenylbenzeneethanol

PropertiesImage
MNX_IDMNXM37379 Image of MNXM37379
referencechebi:79587
formulaC26H30ClNO2
global charge0
mol weight423.984
InChIKeyJGLROVOJKXIJKB-UHFFFAOYSA-N
InChIInChI=1S/C26H30ClNO2/c1-3-28(4-2)18-19-30-25-16-12-23(13-17-25)26(29,22-8-6-5-7-9-22)20-21-10-14-24(27)15-11-21/h5-17,29H,3-4,18-20H2,1-2H3
SMILESCCN(CC)CCOC1=CC=C(C(O)(CC2=CC=C(Cl)C=C2)C2=CC=CC=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C26H30ClNO2/c1-3-28(4-2)18-19-30-25-16-12-23(13-17-25)26(29,22-8-6-5-7-9-22)20-21-10-14-24(27)15-11-21/h5-17,29H,3-4,18-20H2,1-2H3/t26? Image of MNXM37379
SMILES (mnx)[CH3:1][CH2:3][N:28]([CH2:4][CH3:2])[CH2:18][CH2:19][O:30][C:25]1=[CH:17][CH:13]=[C:23]([C:26]([CH2:20][C:21]2=[CH:11][CH:15]=[C:24]([Cl:27])[CH:14]=[CH:10]2)([C:22]2=[CH:8][CH:6]=[CH:5][CH:7]=[CH:9]2)[OH:29])[CH:12]=[CH:16]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:79587
chebi:79587
kegg.compound:C15067
keggC:C15067
JGLROVOJKXIJKB-UHFFFAOYSA-N
4-Chloro-alpha-[4-[2-(diethylamino)ethoxy]phenyl]-alpha-phenylbenzeneethanol

seed.compound:cpd10761
seedM:cpd10761
JGLROVOJKXIJKB-UHFFFAOYSA-O
4-Chloro-alpha-[4-[2-(diethylamino)ethoxy]phenyl]-alpha- phenylbenzeneethanol
4-Chloro-alpha-[4-[2-(diethylamino)ethoxy]phenyl]-alpha-phenylbenzeneethanol

keggC:M_C15067
seedM:M_cpd10761
secondary/obsolete/fantasy identifier