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English
4-(2-{4-[(E)-Phenyldiazenyl]phenyl}hydrazinylidene)-2-{[(pyridin-2-yl)imino]methyl}cyclohexa-2,5-dien-1-one
group of stereoisomers with the chemical formula C₂₄H₁₈N₆O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
406.15420919600007
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₄H₁₈N₆O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C1C=CC(=NNc2ccc(/N=N/c3ccccc3)cc2)C=C1C=Nc1ccccn1
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
O=C1C=CC(=NNc2ccc(/N=N/c3ccccc3)cc2)C=C1C=Nc1ccccn1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C24H18N6O/c31-23-14-13-22(16-18(23)17-26-24-8-4-5-15-25-24)30-29-21-11-9-20(10-12-21)28-27-19-6-2-1-3-7-19/h1-17,29H/b26-17?,28-27+,30-22?
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InChIKey
SQQPJYLVVJDAPR-OROQEWBVSA-N
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CAS Registry Number
62589-55-3
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DSSTox substance ID
DTXSID00807157
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DSSTOX compound identifier
DTXCID40757900
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