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(Q82662985)
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English
(5Z)-1H-Indolo[3,2-e][1]benzazocine
group of stereoisomers with the chemical formula C₁₇H₁₂N₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
244.100048384
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₂N₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C1=CCC2=C3N=c4ccccc4=C3C=C/C=N\C2=C1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
C1=CCC2=C3N=c4ccccc4=C3C=C/C=N\C2=C1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H12N2/c1-4-10-16-12(6-1)13-8-5-11-18-15-9-3-2-7-14(15)17(13)19-16/h1-6,8-11H,7H2/b8-5?,17-14?,18-11-
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InChIKey
OYEXKRWKLGUINI-IUNMFSFXSA-N
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CAS Registry Number
909776-26-7
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DSSTox substance ID
DTXSID20723264
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DSSTOX compound identifier
DTXCID60674009
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