6-bromanyl-2-(2-carboxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-(2-carboxyphenyl)quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-(2-carboxyphenyl)quinoline-4-carboxylic acid CAS Name: 6-bromo-2-(2-carboxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-(2-carboxyphenyl)quinoline-4-carboxylic acid Traditional Name: 6-bromo-2-(2-carboxyphenyl)cinchoninic acid Formula: C17H10BrNO4 MolecularWeight: 372.1696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10BrNO4/c18-9-5-6-14-12(7-9)13(17(22)23)8-15(19-14)10-3-1-2-4-11(10)16(20)21/h1-8H,(H,20,21)(H,22,23)