6-bromanyl-3-oxidanyl-2-(4-phenylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-3-oxidanyl-2-(4-phenylphenyl)quinoline-4-carboxylic acid Openeye Name: 6-bromo-3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid CAS Name: 6-bromo-3-hydroxy-2-(4-phenylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-3-hydroxy-2-(4-phenylphenyl)quinoline-4-carboxylic acid Traditional Name: 6-bromo-3-hydroxy-2-(4-phenylphenyl)cinchoninic acid Formula: C22H14BrNO3 MolecularWeight: 420.25546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)Br)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(C(=C4C=C(C=CC4=N3)Br)C(=O)O)O

InChI

InChI=1S/C22H14BrNO3/c23-16-10-11-18-17(12-16)19(22(26)27)21(25)20(24-18)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12,25H,(H,26,27)