2-(3-bromophenyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(3-bromophenyl)quinoline-4-carboxylic acid Openeye Name: 2-(3-bromophenyl)quinoline-4-carboxylic acid CAS Name: 2-(3-bromophenyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-bromophenyl)quinoline-4-carboxylic acid Traditional Name: 2-(3-bromophenyl)cinchoninic acid Formula: C16H10BrNO2 MolecularWeight: 328.1601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrNO2/c17-11-5-3-4-10(8-11)15-9-13(16(19)20)12-6-1-2-7-14(12)18-15/h1-9H,(H,19,20)