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The molecular formula is C20H18BrNO4.
The PubChem CID is 993996.
The IUPAC name is 6-bromo-2-(2,4-diethoxyphenyl)quinoline-4-carboxylic acid.
The InChI is InChI=1S/C20H18BrNO4/c1-3-25-13-6-7-14(19(10-13)26-4-2)18-11-16(20(23)24)15-9-12(21)5-8-17(15)22-18/h5-11H,3-4H2,1-2H3,(H,23,24).
The InChIKey is KZYDJVKDQJNUED-UHFFFAOYSA-N.
The Canonical SMILES is CCOC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC.
The molecular weight is 416.3 g/mol.
The CAS number is 494860-96-7.
It has 1 hydrogen bond donor count.
It has 6 rotatable bond counts.
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