2-[(2-bromophenyl)amino]quinoline-4-carboxylic acid

Systemtic Name: 2-[(2-bromophenyl)amino]quinoline-4-carboxylic acid Openeye Name: 2-(2-bromoanilino)quinoline-4-carboxylic acid CAS Name: 2-(2-bromoanilino)-4-quinolinecarboxylic acid IUPAC Name: 2-(2-bromoanilino)quinoline-4-carboxylic acid Traditional Name: 2-(2-bromoanilino)cinchoninic acid Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)NC3=CC=CC=C3Br)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)NC3=CC=CC=C3Br)C(=O)O

InChI

InChI=1S/C16H11BrN2O2/c17-12-6-2-4-8-14(12)19-15-9-11(16(20)21)10-5-1-3-7-13(10)18-15/h1-9H,(H,18,19)(H,20,21)