(4-bromanyl-2-fluoranyl-phenyl)methyl quinoline-2-carboxylate

Systemtic Name: (4-bromanyl-2-fluoranyl-phenyl)methyl quinoline-2-carboxylate Openeye Name: (4-bromo-2-fluoro-phenyl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (4-bromo-2-fluorophenyl)methyl ester IUPAC Name: (4-bromo-2-fluorophenyl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (4-bromo-2-fluoro-benzyl) ester Formula: C17H11BrFNO2 MolecularWeight: 360.177143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H11BrFNO2/c18-13-7-5-12(14(19)9-13)10-22-17(21)16-8-6-11-3-1-2-4-15(11)20-16/h1-9H,10H2