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N-methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

PropertiesImage
MNX_IDMNXM4229 Image of MNXM4229
referencechebi:57598
formulaC17H20N
global charge1
mol weight238.354
InChIKeyVKRKVLLLTIHDEF-UHFFFAOYSA-O
InChIInChI=1S/C17H19N/c1-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3/p+1
SMILESC[NH+]1CCC2=CC=CC=C2C1CC1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C17H19N/c1-18-12-11-15-9-5-6-10-16(15)17(18)13-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3/t17? Image of MNXM4229
SMILES (mnx)[CH3:1][N:18]1[CH2:12][CH2:11][C:15]2=[CH:9][CH:5]=[CH:6][CH:10]=[C:16]2[CH:17]1[CH2:13][C:14]1=[CH:7][CH:3]=[CH:2][CH:4]=[CH:8]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57598
chebi:57598
VKRKVLLLTIHDEF-UHFFFAOYSA-O
N-methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinolinium

CHEBI:15979
chebi:15979
VKRKVLLLTIHDEF-UHFFFAOYSA-N
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline
N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
N-methyl-1-benzyl-1,2,3,4-tetrahydroisoquinoline

seed.compound:cpd03152
seedM:cpd03152
VKRKVLLLTIHDEF-UHFFFAOYSA-O
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
N-methyl-(R,S)-tetrahydrobenzylisoquinoline
N-methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

kegg.compound:C05314
keggC:C05314
VKRKVLLLTIHDEF-UHFFFAOYSA-N
N-Methyl-(R,S)-tetrahydrobenzylisoquinoline
N-Methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

metacyc.compound:N-METHYL-RS-TETRAHYDROBENZYLISOQUINOL
metacycM:N-METHYL-RS-TETRAHYDROBENZYLISOQUINOL
VKRKVLLLTIHDEF-UHFFFAOYSA-O
N-methyl-(R,S)-tetrahydrobenzylisoquinoline
1-benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline
N-methyl-(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

chebi:12604
chebi:21748
chebi:7304
chebi:7305
keggC:M_C05314
seedM:M_cpd03152
secondary/obsolete/fantasy identifier