4-[(3-bromophenyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 4-[(3-bromophenyl)amino]quinoline-3-carboxylic acid Openeye Name: 4-(3-bromoanilino)quinoline-3-carboxylic acid CAS Name: 4-(3-bromoanilino)-3-quinolinecarboxylic acid IUPAC Name: 4-(3-bromoanilino)quinoline-3-carboxylic acid Traditional Name: 4-(3-bromoanilino)quinoline-3-carboxylic acid Formula: C16H11BrN2O2 MolecularWeight: 343.17474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)O)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)O)NC3=CC(=CC=C3)Br

InChI

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