6-azanyl-2-(4-bromophenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-azanyl-2-(4-bromophenyl)quinoline-4-carboxylic acid Openeye Name: 6-amino-2-(4-bromophenyl)quinoline-4-carboxylic acid CAS Name: 6-amino-2-(4-bromophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-amino-2-(4-bromophenyl)quinoline-4-carboxylic acid Traditional Name: 6-amino-2-(4-bromophenyl)cinchoninic acid Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)N)C(=C2)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)N)C(=C2)C(=O)O)Br

InChI

InChI=1S/C16H11BrN2O2/c17-10-3-1-9(2-4-10)15-8-13(16(20)21)12-7-11(18)5-6-14(12)19-15/h1-8H,18H2,(H,20,21)