phenacyl 6-bromanyl-2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: phenacyl 6-bromanyl-2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: phenacyl 6-bromo-2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(4-fluorophenyl)-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 6-bromo-2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(4-fluorophenyl)cinchoninic acid phenacyl ester Formula: C24H15BrFNO3 MolecularWeight: 464.283203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H15BrFNO3/c25-17-8-11-21-19(12-17)20(13-22(27-21)15-6-9-18(26)10-7-15)24(29)30-14-23(28)16-4-2-1-3-5-16/h1-13H,14H2