2-[5-[3,5-bis(chloranyl)phenyl]furan-2-yl]-6-bromanyl-quinoline-4-carboxylate

Systemtic Name: 2-[5-[3,5-bis(chloranyl)phenyl]furan-2-yl]-6-bromanyl-quinoline-4-carboxylate Openeye Name: 6-bromo-2-[5-(3,5-dichlorophenyl)-2-furyl]quinoline-4-carboxylate CAS Name: 6-bromo-2-[5-(3,5-dichlorophenyl)-2-furanyl]-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-[5-(3,5-dichlorophenyl)furan-2-yl]quinoline-4-carboxylate Traditional Name: 6-bromo-2-[5-(3,5-dichlorophenyl)-2-furyl]cinchoninate Formula: C20H9BrCl2NO3- MolecularWeight: 462.10036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=CC(=N2)C3=CC=C(O3)C4=CC(=CC(=C4)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=CC(=N2)C3=CC=C(O3)C4=CC(=CC(=C4)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C20H10BrCl2NO3/c21-11-1-2-16-14(7-11)15(20(25)26)9-17(24-16)19-4-3-18(27-19)10-5-12(22)8-13(23)6-10/h1-9H,(H,25,26)/p-1