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The IUPAC name of the compound is 1-(4-methoxyphenyl)-2,2-bis(4-nitroanilino)ethanone.
The molecular formula of the compound is C21H18N4O6.
The molecular weight of the compound is 422.4 g/mol.
The CAS number of the compound is 94872-51-2.
The InChIKey of the compound is AIGAUWTXIDBLBR-UHFFFAOYSA-N.
The Canonical SMILES of the compound is COC1=CC=C(C=C1)C(=O)C(NC2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=C(C=C3)[N+](=O)[O-].
The XLogP3-AA value of the compound is 4.8.
The compound has 2 hydrogen bond donor counts.
The compound has 8 hydrogen bond acceptor counts.
The compound has 7 rotatable bond counts.
948663
94868-65-2
94-87-1
948758
94-88-2
94882-74-3
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