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

Systemtic Name: 2-[2,5-bis(chloranyl)phenyl]-6-bromanyl-quinoline-4-carboxylate Openeye Name: 6-bromo-2-(2,5-dichlorophenyl)quinoline-4-carboxylate CAS Name: 6-bromo-2-(2,5-dichlorophenyl)-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-(2,5-dichlorophenyl)quinoline-4-carboxylate Traditional Name: 6-bromo-2-(2,5-dichlorophenyl)cinchoninate Formula: C16H7BrCl2NO2- MolecularWeight: 396.04228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C16H8BrCl2NO2/c17-8-1-4-14-10(5-8)11(16(21)22)7-15(20-14)12-6-9(18)2-3-13(12)19/h1-7H,(H,21,22)/p-1